USER MOD reduce.3.24.130724 H: found=0, std=0, add=881, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 879 hydrogens (32 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj-H: A 18 HIS HE2 : A 18 HIS NE2 : A 105 HECFE :(H bumps) USER MOD NoAdj-H: A 105 HEC HAC : A 105 HEC CAC : A 17 CYS SG :(H bumps) USER MOD NoAdj-H: A 105 HEC HAB : A 105 HEC CAB : A 14 CYS SG :(H bumps) USER MOD Set 1.1: A 52 ASN : amide:sc= -0.379 K(o=2.8,f=-0.86) USER MOD Set 1.2: A 78 THR OG1 : rot 110:sc= 1.05 USER MOD Set 1.3: A 105 HEC O2D : rot -79:sc= 2.14 USER MOD Set 2.1: A 99 LYS NZ :NH3+ 177:sc= 1.58 (180deg=1.24) USER MOD Set 2.2: A 102 THR OG1 : rot 140:sc= 1.23 USER MOD Set 2.3: A 103 ASN : amide:sc= 2.25 K(o=5.1,f=3.5) USER MOD Set 3.1: A 67 TYR OH : rot -140:sc= 0.254 USER MOD Set 3.2: A 80 MET CE :methyl -177:sc= -1.03 (180deg=-1.08) USER MOD Set 4.1: A 70 ASN : amide:sc= 2.34 K(o=3.5,f=-5.9!) USER MOD Set 4.2: A 73 LYS NZ :NH3+ -165:sc= 1.2 (180deg=0) USER MOD Set 5.1: A 31 ASN : amide:sc= -1.79! C(o=-4.8!,f=-7.3!) USER MOD Set 5.2: A 33 HIS : no HE2:sc= -2.97! C(o=-4.8!,f=-5.3!) USER MOD Set 6.1: A 16 GLN : amide:sc= -0.313 K(o=0.82,f=-4) USER MOD Set 6.2: A 27 LYS NZ :NH3+ 151:sc= 1.13 (180deg=0.426) USER MOD Single : A 1 GLY N :NH3+ -163:sc= 2.28 (180deg=1.89) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 LYS NZ :NH3+ -152:sc= 1.2 (180deg=0.296) USER MOD Single : A 8 LYS NZ :NH3+ 157:sc= 1.15 (180deg=-0.0438) USER MOD Single : A 12 GLN : amide:sc= -0.0787 X(o=-0.079,f=-0.066) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 THR OG1 : rot -122:sc= 1.32 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 HIS : no HE2:sc= 0.0129 K(o=0.013,f=-2.6!) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 THR OG1 : rot -65:sc= 1.62 USER MOD Single : A 42 GLN : amide:sc= -0.019 X(o=-0.019,f=-0.019) USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 TYR OH : rot 174:sc= 1.28 USER MOD Single : A 49 THR OG1 : rot 150:sc= 0.0486 USER MOD Single : A 53 LYS NZ :NH3+ -176:sc= 0.381 (180deg=0.203) USER MOD Single : A 54 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 55 LYS NZ :NH3+ 164:sc= 2.37 (180deg=1.35) USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ -159:sc= 0.942 (180deg=0.634) USER MOD Single : A 63 THR OG1 : rot 170:sc= 1.2 USER MOD Single : A 65 MET CE :methyl -177:sc= -0.0137 (180deg=-0.0304) USER MOD Single : A 72 LYS NZ :NH3+ -172:sc= 1.21 (180deg=1.15) USER MOD Single : A 74 TYR OH : rot 30:sc= -0.33 USER MOD Single : A 79 LYS NZ :NH3+ -173:sc=-0.000177 (180deg=-0.0871) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 LYS NZ :NH3+ -154:sc= 1.29 (180deg=1.16) USER MOD Single : A 89 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 TYR OH : rot 14:sc= 0.147 USER MOD Single : A 100 LYS NZ :NH3+ -160:sc= 2.13 (180deg=0.407!) USER MOD Single : A 105 HEC O2A : rot -105:sc= 0.964 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 1.974 0.931 -1.284 1.00 10.00 N ATOM 2 CA GLY A 1 2.383 2.211 -0.687 1.00 10.00 C ATOM 3 C GLY A 1 1.890 2.338 0.743 1.00 10.00 C ATOM 4 O GLY A 1 2.698 2.268 1.660 1.00 10.00 O ATOM 0 H1 GLY A 1 2.549 0.743 -2.130 1.00 10.00 H new ATOM 0 H2 GLY A 1 2.114 0.166 -0.594 1.00 10.00 H new ATOM 0 H3 GLY A 1 0.970 0.978 -1.551 1.00 10.00 H new ATOM 0 HA2 GLY A 1 3.470 2.293 -0.707 1.00 10.00 H new ATOM 0 HA3 GLY A 1 1.990 3.034 -1.283 1.00 10.00 H new ATOM 10 N ASP A 2 0.581 2.509 0.916 1.00 10.00 N ATOM 11 CA ASP A 2 -0.125 2.573 2.197 1.00 10.00 C ATOM 12 C ASP A 2 -0.670 1.178 2.597 1.00 10.00 C ATOM 13 O ASP A 2 -0.338 0.172 1.968 1.00 10.00 O ATOM 14 CB ASP A 2 -1.243 3.624 2.058 1.00 10.00 C ATOM 15 CG ASP A 2 -0.715 5.021 1.708 1.00 10.00 C ATOM 16 OD1 ASP A 2 0.096 5.543 2.503 1.00 10.00 O ATOM 17 OD2 ASP A 2 -1.140 5.560 0.658 1.00 10.00 O ATOM 0 H ASP A 2 -0.052 2.613 0.123 1.00 10.00 H new ATOM 0 HA ASP A 2 0.550 2.870 3.000 1.00 10.00 H new ATOM 0 HB2 ASP A 2 -1.942 3.302 1.286 1.00 10.00 H new ATOM 0 HB3 ASP A 2 -1.802 3.677 2.992 1.00 10.00 H new ATOM 22 N VAL A 3 -1.465 1.072 3.676 1.00 10.00 N ATOM 23 CA VAL A 3 -2.603 0.124 3.734 1.00 10.00 C ATOM 24 C VAL A 3 -3.825 0.672 2.965 1.00 10.00 C ATOM 25 O VAL A 3 -4.647 -0.069 2.421 1.00 10.00 O ATOM 26 CB VAL A 3 -2.941 -0.192 5.211 1.00 10.00 C ATOM 27 CG1 VAL A 3 -4.288 -0.899 5.400 1.00 10.00 C ATOM 28 CG2 VAL A 3 -1.863 -1.082 5.841 1.00 10.00 C ATOM 0 H VAL A 3 -1.344 1.629 4.522 1.00 10.00 H new ATOM 0 HA VAL A 3 -2.318 -0.806 3.243 1.00 10.00 H new ATOM 0 HB VAL A 3 -2.991 0.781 5.699 1.00 10.00 H new ATOM 0 HG11 VAL A 3 -4.455 -1.087 6.461 1.00 10.00 H new ATOM 0 HG12 VAL A 3 -5.088 -0.267 5.013 1.00 10.00 H new ATOM 0 HG13 VAL A 3 -4.281 -1.846 4.860 1.00 10.00 H new ATOM 0 HG21 VAL A 3 -2.124 -1.290 6.879 1.00 10.00 H new ATOM 0 HG22 VAL A 3 -1.797 -2.019 5.289 1.00 10.00 H new ATOM 0 HG23 VAL A 3 -0.901 -0.570 5.804 1.00 10.00 H new ATOM 38 N GLU A 4 -3.970 1.999 2.988 1.00 10.00 N ATOM 39 CA GLU A 4 -5.180 2.778 2.731 1.00 10.00 C ATOM 40 C GLU A 4 -5.657 2.729 1.295 1.00 10.00 C ATOM 41 O GLU A 4 -6.867 2.698 1.057 1.00 10.00 O ATOM 42 CB GLU A 4 -4.931 4.239 3.130 1.00 10.00 C ATOM 43 CG GLU A 4 -4.989 4.509 4.636 1.00 10.00 C ATOM 44 CD GLU A 4 -4.384 3.371 5.460 1.00 10.00 C ATOM 45 OE1 GLU A 4 -3.150 3.181 5.366 1.00 10.00 O ATOM 46 OE2 GLU A 4 -5.209 2.603 6.017 1.00 10.00 O ATOM 0 H GLU A 4 -3.178 2.604 3.205 1.00 10.00 H new ATOM 0 HA GLU A 4 -5.970 2.326 3.331 1.00 10.00 H new ATOM 0 HB2 GLU A 4 -3.952 4.541 2.758 1.00 10.00 H new ATOM 0 HB3 GLU A 4 -5.669 4.868 2.633 1.00 10.00 H new ATOM 0 HG2 GLU A 4 -4.458 5.435 4.856 1.00 10.00 H new ATOM 0 HG3 GLU A 4 -6.026 4.658 4.935 1.00 10.00 H new ATOM 53 N LYS A 5 -4.727 2.694 0.339 1.00 10.00 N ATOM 54 CA LYS A 5 -5.074 2.548 -1.068 1.00 10.00 C ATOM 55 C LYS A 5 -5.522 1.102 -1.335 1.00 10.00 C ATOM 56 O LYS A 5 -6.384 0.862 -2.178 1.00 10.00 O ATOM 57 CB LYS A 5 -3.916 2.992 -1.983 1.00 10.00 C ATOM 58 CG LYS A 5 -3.049 4.160 -1.468 1.00 10.00 C ATOM 59 CD LYS A 5 -2.704 5.176 -2.561 1.00 10.00 C ATOM 60 CE LYS A 5 -3.877 6.149 -2.712 1.00 10.00 C ATOM 61 NZ LYS A 5 -3.657 7.111 -3.814 1.00 10.00 N ATOM 0 H LYS A 5 -3.725 2.765 0.519 1.00 10.00 H new ATOM 0 HA LYS A 5 -5.908 3.208 -1.305 1.00 10.00 H new ATOM 0 HB2 LYS A 5 -3.267 2.133 -2.155 1.00 10.00 H new ATOM 0 HB3 LYS A 5 -4.333 3.275 -2.950 1.00 10.00 H new ATOM 0 HG2 LYS A 5 -3.576 4.668 -0.661 1.00 10.00 H new ATOM 0 HG3 LYS A 5 -2.127 3.762 -1.045 1.00 10.00 H new ATOM 0 HD2 LYS A 5 -1.795 5.717 -2.301 1.00 10.00 H new ATOM 0 HD3 LYS A 5 -2.512 4.666 -3.505 1.00 10.00 H new ATOM 0 HE2 LYS A 5 -4.793 5.588 -2.897 1.00 10.00 H new ATOM 0 HE3 LYS A 5 -4.020 6.693 -1.778 1.00 10.00 H new ATOM 0 HZ1 LYS A 5 -4.473 7.752 -3.883 1.00 10.00 H new ATOM 0 HZ2 LYS A 5 -2.797 7.665 -3.625 1.00 10.00 H new ATOM 0 HZ3 LYS A 5 -3.546 6.594 -4.709 1.00 10.00 H new ATOM 75 N GLY A 6 -5.054 0.157 -0.511 1.00 10.00 N ATOM 76 CA GLY A 6 -5.322 -1.270 -0.601 1.00 10.00 C ATOM 77 C GLY A 6 -6.722 -1.572 -0.117 1.00 10.00 C ATOM 78 O GLY A 6 -7.534 -2.138 -0.848 1.00 10.00 O ATOM 0 H GLY A 6 -4.447 0.387 0.276 1.00 10.00 H new ATOM 0 HA2 GLY A 6 -5.206 -1.604 -1.632 1.00 10.00 H new ATOM 0 HA3 GLY A 6 -4.596 -1.822 -0.003 1.00 10.00 H new ATOM 82 N LYS A 7 -7.023 -1.131 1.108 1.00 10.00 N ATOM 83 CA LYS A 7 -8.348 -1.318 1.688 1.00 10.00 C ATOM 84 C LYS A 7 -9.481 -0.601 0.934 1.00 10.00 C ATOM 85 O LYS A 7 -10.612 -1.072 1.010 1.00 10.00 O ATOM 86 CB LYS A 7 -8.320 -1.057 3.204 1.00 10.00 C ATOM 87 CG LYS A 7 -7.871 0.354 3.616 1.00 10.00 C ATOM 88 CD LYS A 7 -9.033 1.267 4.028 1.00 10.00 C ATOM 89 CE LYS A 7 -8.566 2.654 4.497 1.00 10.00 C ATOM 90 NZ LYS A 7 -7.837 2.622 5.794 1.00 10.00 N ATOM 0 H LYS A 7 -6.364 -0.642 1.714 1.00 10.00 H new ATOM 0 HA LYS A 7 -8.609 -2.368 1.554 1.00 10.00 H new ATOM 0 HB2 LYS A 7 -9.317 -1.236 3.606 1.00 10.00 H new ATOM 0 HB3 LYS A 7 -7.654 -1.783 3.670 1.00 10.00 H new ATOM 0 HG2 LYS A 7 -7.168 0.276 4.446 1.00 10.00 H new ATOM 0 HG3 LYS A 7 -7.334 0.813 2.786 1.00 10.00 H new ATOM 0 HD2 LYS A 7 -9.713 1.384 3.184 1.00 10.00 H new ATOM 0 HD3 LYS A 7 -9.598 0.789 4.829 1.00 10.00 H new ATOM 0 HE2 LYS A 7 -7.919 3.089 3.735 1.00 10.00 H new ATOM 0 HE3 LYS A 7 -9.432 3.309 4.591 1.00 10.00 H new ATOM 0 HZ1 LYS A 7 -7.961 3.531 6.284 1.00 10.00 H new ATOM 0 HZ2 LYS A 7 -8.215 1.855 6.386 1.00 10.00 H new ATOM 0 HZ3 LYS A 7 -6.825 2.458 5.619 1.00 10.00 H new ATOM 104 N LYS A 8 -9.208 0.468 0.159 1.00 10.00 N ATOM 105 CA LYS A 8 -10.165 0.989 -0.844 1.00 10.00 C ATOM 106 C LYS A 8 -10.230 0.143 -2.121 1.00 10.00 C ATOM 107 O LYS A 8 -11.324 -0.255 -2.513 1.00 10.00 O ATOM 108 CB LYS A 8 -10.041 2.513 -1.094 1.00 10.00 C ATOM 109 CG LYS A 8 -8.742 3.067 -1.701 1.00 10.00 C ATOM 110 CD LYS A 8 -8.665 3.146 -3.242 1.00 10.00 C ATOM 111 CE LYS A 8 -7.251 3.562 -3.682 1.00 10.00 C ATOM 112 NZ LYS A 8 -7.080 3.566 -5.152 1.00 10.00 N ATOM 0 H LYS A 8 -8.333 0.989 0.207 1.00 10.00 H new ATOM 0 HA LYS A 8 -11.148 0.874 -0.388 1.00 10.00 H new ATOM 0 HB2 LYS A 8 -10.861 2.806 -1.749 1.00 10.00 H new ATOM 0 HB3 LYS A 8 -10.199 3.016 -0.140 1.00 10.00 H new ATOM 0 HG2 LYS A 8 -8.582 4.069 -1.302 1.00 10.00 H new ATOM 0 HG3 LYS A 8 -7.915 2.449 -1.352 1.00 10.00 H new ATOM 0 HD2 LYS A 8 -8.919 2.179 -3.676 1.00 10.00 H new ATOM 0 HD3 LYS A 8 -9.396 3.864 -3.614 1.00 10.00 H new ATOM 0 HE2 LYS A 8 -7.034 4.557 -3.294 1.00 10.00 H new ATOM 0 HE3 LYS A 8 -6.524 2.881 -3.239 1.00 10.00 H new ATOM 0 HZ1 LYS A 8 -6.294 4.197 -5.408 1.00 10.00 H new ATOM 0 HZ2 LYS A 8 -6.870 2.602 -5.480 1.00 10.00 H new ATOM 0 HZ3 LYS A 8 -7.955 3.902 -5.602 1.00 10.00 H new ATOM 126 N ILE A 9 -9.099 -0.132 -2.788 1.00 10.00 N ATOM 127 CA ILE A 9 -9.121 -0.751 -4.126 1.00 10.00 C ATOM 128 C ILE A 9 -9.547 -2.222 -4.086 1.00 10.00 C ATOM 129 O ILE A 9 -10.228 -2.680 -5.008 1.00 10.00 O ATOM 130 CB ILE A 9 -7.772 -0.557 -4.850 1.00 10.00 C ATOM 131 CG1 ILE A 9 -7.831 -0.847 -6.367 1.00 10.00 C ATOM 132 CG2 ILE A 9 -6.680 -1.445 -4.251 1.00 10.00 C ATOM 133 CD1 ILE A 9 -8.714 0.128 -7.155 1.00 10.00 C ATOM 0 H ILE A 9 -8.164 0.062 -2.428 1.00 10.00 H new ATOM 0 HA ILE A 9 -9.884 -0.233 -4.706 1.00 10.00 H new ATOM 0 HB ILE A 9 -7.538 0.498 -4.707 1.00 10.00 H new ATOM 0 HG12 ILE A 9 -6.820 -0.814 -6.772 1.00 10.00 H new ATOM 0 HG13 ILE A 9 -8.202 -1.861 -6.518 1.00 10.00 H new ATOM 0 HG21 ILE A 9 -5.744 -1.282 -4.786 1.00 10.00 H new ATOM 0 HG22 ILE A 9 -6.545 -1.196 -3.199 1.00 10.00 H new ATOM 0 HG23 ILE A 9 -6.972 -2.491 -4.341 1.00 10.00 H new ATOM 0 HD11 ILE A 9 -8.703 -0.143 -8.211 1.00 10.00 H new ATOM 0 HD12 ILE A 9 -9.736 0.079 -6.779 1.00 10.00 H new ATOM 0 HD13 ILE A 9 -8.332 1.142 -7.037 1.00 10.00 H new ATOM 145 N PHE A 10 -9.236 -2.942 -2.998 1.00 10.00 N ATOM 146 CA PHE A 10 -9.737 -4.298 -2.800 1.00 10.00 C ATOM 147 C PHE A 10 -11.261 -4.304 -2.854 1.00 10.00 C ATOM 148 O PHE A 10 -11.857 -5.031 -3.646 1.00 10.00 O ATOM 149 CB PHE A 10 -9.225 -4.906 -1.488 1.00 10.00 C ATOM 150 CG PHE A 10 -9.481 -6.399 -1.436 1.00 10.00 C ATOM 151 CD1 PHE A 10 -10.733 -6.894 -1.026 1.00 10.00 C ATOM 152 CD2 PHE A 10 -8.489 -7.298 -1.868 1.00 10.00 C ATOM 153 CE1 PHE A 10 -10.993 -8.273 -1.082 1.00 10.00 C ATOM 154 CE2 PHE A 10 -8.733 -8.680 -1.852 1.00 10.00 C ATOM 155 CZ PHE A 10 -9.993 -9.169 -1.483 1.00 10.00 C ATOM 0 H PHE A 10 -8.639 -2.602 -2.244 1.00 10.00 H new ATOM 0 HA PHE A 10 -9.356 -4.923 -3.608 1.00 10.00 H new ATOM 0 HB2 PHE A 10 -8.157 -4.714 -1.389 1.00 10.00 H new ATOM 0 HB3 PHE A 10 -9.716 -4.421 -0.644 1.00 10.00 H new ATOM 0 HD1 PHE A 10 -11.493 -6.214 -0.669 1.00 10.00 H new ATOM 0 HD2 PHE A 10 -7.537 -6.924 -2.213 1.00 10.00 H new ATOM 0 HE1 PHE A 10 -11.971 -8.646 -0.814 1.00 10.00 H new ATOM 0 HE2 PHE A 10 -7.947 -9.369 -2.125 1.00 10.00 H new ATOM 0 HZ PHE A 10 -10.192 -10.230 -1.507 1.00 10.00 H new ATOM 165 N VAL A 11 -11.903 -3.428 -2.078 1.00 10.00 N ATOM 166 CA VAL A 11 -13.363 -3.359 -2.000 1.00 10.00 C ATOM 167 C VAL A 11 -14.011 -2.856 -3.309 1.00 10.00 C ATOM 168 O VAL A 11 -15.219 -2.966 -3.492 1.00 10.00 O ATOM 169 CB VAL A 11 -13.785 -2.547 -0.750 1.00 10.00 C ATOM 170 CG1 VAL A 11 -15.305 -2.456 -0.544 1.00 10.00 C ATOM 171 CG2 VAL A 11 -13.210 -3.205 0.514 1.00 10.00 C ATOM 0 H VAL A 11 -11.426 -2.747 -1.487 1.00 10.00 H new ATOM 0 HA VAL A 11 -13.749 -4.372 -1.882 1.00 10.00 H new ATOM 0 HB VAL A 11 -13.399 -1.542 -0.919 1.00 10.00 H new ATOM 0 HG11 VAL A 11 -15.516 -1.872 0.351 1.00 10.00 H new ATOM 0 HG12 VAL A 11 -15.761 -1.973 -1.408 1.00 10.00 H new ATOM 0 HG13 VAL A 11 -15.717 -3.458 -0.429 1.00 10.00 H new ATOM 0 HG21 VAL A 11 -13.509 -2.631 1.391 1.00 10.00 H new ATOM 0 HG22 VAL A 11 -13.590 -4.223 0.599 1.00 10.00 H new ATOM 0 HG23 VAL A 11 -12.122 -3.228 0.449 1.00 10.00 H new ATOM 181 N GLN A 12 -13.204 -2.376 -4.261 1.00 10.00 N ATOM 182 CA GLN A 12 -13.637 -1.879 -5.567 1.00 10.00 C ATOM 183 C GLN A 12 -13.523 -2.959 -6.646 1.00 10.00 C ATOM 184 O GLN A 12 -14.454 -3.133 -7.429 1.00 10.00 O ATOM 185 CB GLN A 12 -12.781 -0.657 -5.939 1.00 10.00 C ATOM 186 CG GLN A 12 -13.266 0.116 -7.176 1.00 10.00 C ATOM 187 CD GLN A 12 -14.699 0.639 -7.091 1.00 10.00 C ATOM 188 OE1 GLN A 12 -15.443 0.585 -8.056 1.00 10.00 O ATOM 189 NE2 GLN A 12 -15.128 1.183 -5.967 1.00 10.00 N ATOM 0 H GLN A 12 -12.193 -2.322 -4.136 1.00 10.00 H new ATOM 0 HA GLN A 12 -14.688 -1.595 -5.506 1.00 10.00 H new ATOM 0 HB2 GLN A 12 -12.756 0.024 -5.089 1.00 10.00 H new ATOM 0 HB3 GLN A 12 -11.757 -0.987 -6.113 1.00 10.00 H new ATOM 0 HG2 GLN A 12 -12.597 0.960 -7.344 1.00 10.00 H new ATOM 0 HG3 GLN A 12 -13.184 -0.534 -8.047 1.00 10.00 H new ATOM 0 HE21 GLN A 12 -14.511 1.232 -5.156 1.00 10.00 H new ATOM 0 HE22 GLN A 12 -16.076 1.555 -5.910 1.00 10.00 H new ATOM 198 N LYS A 13 -12.376 -3.658 -6.717 1.00 10.00 N ATOM 199 CA LYS A 13 -12.052 -4.570 -7.825 1.00 10.00 C ATOM 200 C LYS A 13 -11.825 -6.030 -7.429 1.00 10.00 C ATOM 201 O LYS A 13 -11.760 -6.880 -8.310 1.00 10.00 O ATOM 202 CB LYS A 13 -10.865 -4.019 -8.633 1.00 10.00 C ATOM 203 CG LYS A 13 -11.146 -2.690 -9.356 1.00 10.00 C ATOM 204 CD LYS A 13 -12.344 -2.770 -10.317 1.00 10.00 C ATOM 205 CE LYS A 13 -12.431 -1.509 -11.177 1.00 10.00 C ATOM 206 NZ LYS A 13 -13.603 -1.538 -12.084 1.00 10.00 N ATOM 0 H LYS A 13 -11.647 -3.605 -6.005 1.00 10.00 H new ATOM 0 HA LYS A 13 -12.947 -4.600 -8.447 1.00 10.00 H new ATOM 0 HB2 LYS A 13 -10.018 -3.880 -7.961 1.00 10.00 H new ATOM 0 HB3 LYS A 13 -10.568 -4.764 -9.371 1.00 10.00 H new ATOM 0 HG2 LYS A 13 -11.333 -1.912 -8.615 1.00 10.00 H new ATOM 0 HG3 LYS A 13 -10.259 -2.392 -9.914 1.00 10.00 H new ATOM 0 HD2 LYS A 13 -12.245 -3.647 -10.957 1.00 10.00 H new ATOM 0 HD3 LYS A 13 -13.266 -2.893 -9.748 1.00 10.00 H new ATOM 0 HE2 LYS A 13 -12.493 -0.633 -10.531 1.00 10.00 H new ATOM 0 HE3 LYS A 13 -11.519 -1.407 -11.765 1.00 10.00 H new ATOM 0 HZ1 LYS A 13 -13.626 -0.666 -12.650 1.00 10.00 H new ATOM 0 HZ2 LYS A 13 -13.531 -2.360 -12.718 1.00 10.00 H new ATOM 0 HZ3 LYS A 13 -14.475 -1.609 -11.522 1.00 10.00 H new ATOM 220 N CYS A 14 -11.762 -6.336 -6.134 1.00 10.00 N ATOM 221 CA CYS A 14 -11.527 -7.678 -5.604 1.00 10.00 C ATOM 222 C CYS A 14 -12.752 -8.202 -4.854 1.00 10.00 C ATOM 223 O CYS A 14 -13.179 -9.336 -5.081 1.00 10.00 O ATOM 224 CB CYS A 14 -10.331 -7.621 -4.660 1.00 10.00 C ATOM 225 SG CYS A 14 -8.831 -6.836 -5.310 1.00 10.00 S ATOM 0 H CYS A 14 -11.877 -5.635 -5.402 1.00 10.00 H new ATOM 0 HA CYS A 14 -11.330 -8.358 -6.433 1.00 10.00 H new ATOM 0 HB2 CYS A 14 -10.632 -7.089 -3.758 1.00 10.00 H new ATOM 0 HB3 CYS A 14 -10.082 -8.639 -4.361 1.00 10.00 H new ATOM 230 N ALA A 15 -13.356 -7.360 -4.001 1.00 10.00 N ATOM 231 CA ALA A 15 -14.578 -7.708 -3.274 1.00 10.00 C ATOM 232 C ALA A 15 -15.739 -8.081 -4.212 1.00 10.00 C ATOM 233 O ALA A 15 -16.582 -8.897 -3.846 1.00 10.00 O ATOM 234 CB ALA A 15 -14.976 -6.568 -2.340 1.00 10.00 C ATOM 0 H ALA A 15 -13.009 -6.422 -3.799 1.00 10.00 H new ATOM 0 HA ALA A 15 -14.362 -8.597 -2.682 1.00 10.00 H new ATOM 0 HB1 ALA A 15 -15.886 -6.837 -1.804 1.00 10.00 H new ATOM 0 HB2 ALA A 15 -14.174 -6.387 -1.624 1.00 10.00 H new ATOM 0 HB3 ALA A 15 -15.153 -5.664 -2.923 1.00 10.00 H new ATOM 240 N GLN A 16 -15.698 -7.571 -5.452 1.00 10.00 N ATOM 241 CA GLN A 16 -16.539 -7.908 -6.603 1.00 10.00 C ATOM 242 C GLN A 16 -16.604 -9.421 -6.916 1.00 10.00 C ATOM 243 O GLN A 16 -17.527 -9.850 -7.605 1.00 10.00 O ATOM 244 CB GLN A 16 -16.026 -7.069 -7.790 1.00 10.00 C ATOM 245 CG GLN A 16 -16.970 -6.954 -9.004 1.00 10.00 C ATOM 246 CD GLN A 16 -16.936 -8.145 -9.962 1.00 10.00 C ATOM 247 OE1 GLN A 16 -17.950 -8.765 -10.255 1.00 10.00 O ATOM 248 NE2 GLN A 16 -15.784 -8.498 -10.498 1.00 10.00 N ATOM 0 H GLN A 16 -15.016 -6.851 -5.692 1.00 10.00 H new ATOM 0 HA GLN A 16 -17.577 -7.663 -6.379 1.00 10.00 H new ATOM 0 HB2 GLN A 16 -15.808 -6.064 -7.430 1.00 10.00 H new ATOM 0 HB3 GLN A 16 -15.083 -7.497 -8.129 1.00 10.00 H new ATOM 0 HG2 GLN A 16 -17.990 -6.827 -8.642 1.00 10.00 H new ATOM 0 HG3 GLN A 16 -16.715 -6.052 -9.560 1.00 10.00 H new ATOM 0 HE21 GLN A 16 -14.933 -7.988 -10.260 1.00 10.00 H new ATOM 0 HE22 GLN A 16 -15.744 -9.281 -11.150 1.00 10.00 H new ATOM 257 N CYS A 17 -15.707 -10.239 -6.348 1.00 10.00 N ATOM 258 CA CYS A 17 -15.662 -11.692 -6.503 1.00 10.00 C ATOM 259 C CYS A 17 -15.286 -12.404 -5.186 1.00 10.00 C ATOM 260 O CYS A 17 -15.838 -13.466 -4.883 1.00 10.00 O ATOM 261 CB CYS A 17 -14.647 -12.012 -7.608 1.00 10.00 C ATOM 262 SG CYS A 17 -15.186 -11.625 -9.306 1.00 10.00 S ATOM 0 H CYS A 17 -14.964 -9.888 -5.744 1.00 10.00 H new ATOM 0 HA CYS A 17 -16.652 -12.059 -6.774 1.00 10.00 H new ATOM 0 HB2 CYS A 17 -13.728 -11.463 -7.403 1.00 10.00 H new ATOM 0 HB3 CYS A 17 -14.402 -13.073 -7.556 1.00 10.00 H new ATOM 267 N HIS A 18 -14.417 -11.793 -4.369 1.00 10.00 N ATOM 268 CA HIS A 18 -13.855 -12.370 -3.151 1.00 10.00 C ATOM 269 C HIS A 18 -14.472 -11.838 -1.829 1.00 10.00 C ATOM 270 O HIS A 18 -14.179 -12.385 -0.770 1.00 10.00 O ATOM 271 CB HIS A 18 -12.339 -12.108 -3.210 1.00 10.00 C ATOM 272 CG HIS A 18 -11.629 -12.739 -4.382 1.00 10.00 C ATOM 273 ND1 HIS A 18 -11.396 -14.076 -4.494 1.00 10.00 N ATOM 274 CD2 HIS A 18 -10.985 -12.129 -5.428 1.00 10.00 C ATOM 275 CE1 HIS A 18 -10.608 -14.271 -5.561 1.00 10.00 C ATOM 276 NE2 HIS A 18 -10.334 -13.124 -6.177 1.00 10.00 N ATOM 0 H HIS A 18 -14.077 -10.848 -4.549 1.00 10.00 H new ATOM 0 HA HIS A 18 -14.092 -13.434 -3.126 1.00 10.00 H new ATOM 0 HB2 HIS A 18 -12.172 -11.031 -3.240 1.00 10.00 H new ATOM 0 HB3 HIS A 18 -11.886 -12.475 -2.289 1.00 10.00 H new ATOM 0 HD1 HIS A 18 -11.757 -14.802 -3.875 1.00 10.00 H new ATOM 0 HD2 HIS A 18 -10.979 -11.070 -5.639 1.00 10.00 H new ATOM 0 HE1 HIS A 18 -10.242 -15.236 -5.880 1.00 10.00 H new ATOM 284 N THR A 19 -15.301 -10.781 -1.881 1.00 10.00 N ATOM 285 CA THR A 19 -15.790 -9.941 -0.762 1.00 10.00 C ATOM 286 C THR A 19 -14.760 -9.636 0.345 1.00 10.00 C ATOM 287 O THR A 19 -14.072 -8.629 0.222 1.00 10.00 O ATOM 288 CB THR A 19 -17.192 -10.346 -0.287 1.00 10.00 C ATOM 289 OG1 THR A 19 -17.601 -9.555 0.798 1.00 10.00 O ATOM 290 CG2 THR A 19 -17.375 -11.810 0.070 1.00 10.00 C ATOM 0 H THR A 19 -15.679 -10.463 -2.774 1.00 10.00 H new ATOM 0 HA THR A 19 -15.922 -8.947 -1.189 1.00 10.00 H new ATOM 0 HB THR A 19 -17.820 -10.175 -1.161 1.00 10.00 H new ATOM 0 HG1 THR A 19 -17.806 -10.131 1.564 1.00 10.00 H new ATOM 0 HG21 THR A 19 -18.402 -11.980 0.392 1.00 10.00 H new ATOM 0 HG22 THR A 19 -17.161 -12.427 -0.803 1.00 10.00 H new ATOM 0 HG23 THR A 19 -16.693 -12.075 0.878 1.00 10.00 H new ATOM 298 N VAL A 20 -14.631 -10.472 1.387 1.00 10.00 N ATOM 299 CA VAL A 20 -13.642 -10.442 2.487 1.00 10.00 C ATOM 300 C VAL A 20 -13.249 -9.036 3.009 1.00 10.00 C ATOM 301 O VAL A 20 -12.080 -8.716 3.236 1.00 10.00 O ATOM 302 CB VAL A 20 -12.474 -11.412 2.173 1.00 10.00 C ATOM 303 CG1 VAL A 20 -11.553 -10.954 1.038 1.00 10.00 C ATOM 304 CG2 VAL A 20 -11.636 -11.778 3.407 1.00 10.00 C ATOM 0 H VAL A 20 -15.272 -11.258 1.495 1.00 10.00 H new ATOM 0 HA VAL A 20 -14.138 -10.824 3.379 1.00 10.00 H new ATOM 0 HB VAL A 20 -12.988 -12.309 1.827 1.00 10.00 H new ATOM 0 HG11 VAL A 20 -10.766 -11.693 0.888 1.00 10.00 H new ATOM 0 HG12 VAL A 20 -12.131 -10.849 0.120 1.00 10.00 H new ATOM 0 HG13 VAL A 20 -11.106 -9.994 1.297 1.00 10.00 H new ATOM 0 HG21 VAL A 20 -10.837 -12.459 3.115 1.00 10.00 H new ATOM 0 HG22 VAL A 20 -11.204 -10.873 3.835 1.00 10.00 H new ATOM 0 HG23 VAL A 20 -12.272 -12.262 4.148 1.00 10.00 H new ATOM 314 N GLU A 21 -14.261 -8.203 3.282 1.00 10.00 N ATOM 315 CA GLU A 21 -14.107 -6.906 3.961 1.00 10.00 C ATOM 316 C GLU A 21 -14.853 -6.845 5.306 1.00 10.00 C ATOM 317 O GLU A 21 -14.324 -6.334 6.290 1.00 10.00 O ATOM 318 CB GLU A 21 -14.464 -5.746 3.004 1.00 10.00 C ATOM 319 CG GLU A 21 -15.650 -5.921 2.027 1.00 10.00 C ATOM 320 CD GLU A 21 -16.989 -6.191 2.717 1.00 10.00 C ATOM 321 OE1 GLU A 21 -17.264 -7.387 2.983 1.00 10.00 O ATOM 322 OE2 GLU A 21 -17.684 -5.209 3.058 1.00 10.00 O ATOM 0 H GLU A 21 -15.228 -8.413 3.034 1.00 10.00 H new ATOM 0 HA GLU A 21 -13.056 -6.789 4.226 1.00 10.00 H new ATOM 0 HB2 GLU A 21 -14.667 -4.866 3.614 1.00 10.00 H new ATOM 0 HB3 GLU A 21 -13.578 -5.524 2.410 1.00 10.00 H new ATOM 0 HG2 GLU A 21 -15.741 -5.022 1.418 1.00 10.00 H new ATOM 0 HG3 GLU A 21 -15.430 -6.745 1.348 1.00 10.00 H new ATOM 329 N LYS A 22 -16.068 -7.399 5.338 1.00 10.00 N ATOM 330 CA LYS A 22 -17.086 -7.400 6.395 1.00 10.00 C ATOM 331 C LYS A 22 -17.995 -8.624 6.272 1.00 10.00 C ATOM 332 O LYS A 22 -18.344 -9.246 7.271 1.00 10.00 O ATOM 333 CB LYS A 22 -17.966 -6.135 6.310 1.00 10.00 C ATOM 334 CG LYS A 22 -17.227 -4.793 6.475 1.00 10.00 C ATOM 335 CD LYS A 22 -18.107 -3.591 6.104 1.00 10.00 C ATOM 336 CE LYS A 22 -19.338 -3.454 7.004 1.00 10.00 C ATOM 337 NZ LYS A 22 -20.190 -2.326 6.563 1.00 10.00 N ATOM 0 H LYS A 22 -16.402 -7.920 4.527 1.00 10.00 H new ATOM 0 HA LYS A 22 -16.561 -7.422 7.350 1.00 10.00 H new ATOM 0 HB2 LYS A 22 -18.474 -6.133 5.346 1.00 10.00 H new ATOM 0 HB3 LYS A 22 -18.738 -6.200 7.077 1.00 10.00 H new ATOM 0 HG2 LYS A 22 -16.892 -4.690 7.507 1.00 10.00 H new ATOM 0 HG3 LYS A 22 -16.335 -4.793 5.849 1.00 10.00 H new ATOM 0 HD2 LYS A 22 -17.513 -2.679 6.168 1.00 10.00 H new ATOM 0 HD3 LYS A 22 -18.430 -3.690 5.068 1.00 10.00 H new ATOM 0 HE2 LYS A 22 -19.913 -4.380 6.984 1.00 10.00 H new ATOM 0 HE3 LYS A 22 -19.024 -3.296 8.036 1.00 10.00 H new ATOM 0 HZ1 LYS A 22 -21.018 -2.252 7.187 1.00 10.00 H new ATOM 0 HZ2 LYS A 22 -19.644 -1.442 6.605 1.00 10.00 H new ATOM 0 HZ3 LYS A 22 -20.506 -2.491 5.586 1.00 10.00 H new ATOM 351 N GLY A 23 -18.359 -8.958 5.035 1.00 10.00 N ATOM 352 CA GLY A 23 -19.180 -10.097 4.637 1.00 10.00 C ATOM 353 C GLY A 23 -18.364 -11.182 3.927 1.00 10.00 C ATOM 354 O GLY A 23 -17.560 -10.898 3.036 1.00 10.00 O ATOM 0 H GLY A 23 -18.068 -8.402 4.231 1.00 10.00 H new ATOM 0 HA2 GLY A 23 -19.658 -10.524 5.519 1.00 10.00 H new ATOM 0 HA3 GLY A 23 -19.977 -9.755 3.977 1.00 10.00 H new ATOM 358 N GLY A 24 -18.619 -12.440 4.303 1.00 10.00 N ATOM 359 CA GLY A 24 -18.007 -13.642 3.734 1.00 10.00 C ATOM 360 C GLY A 24 -18.913 -14.319 2.705 1.00 10.00 C ATOM 361 O GLY A 24 -20.036 -14.711 3.012 1.00 10.00 O ATOM 0 H GLY A 24 -19.286 -12.656 5.044 1.00 10.00 H new ATOM 0 HA2 GLY A 24 -17.060 -13.378 3.264 1.00 10.00 H new ATOM 0 HA3 GLY A 24 -17.780 -14.346 4.535 1.00 10.00 H new ATOM 365 N LYS A 25 -18.404 -14.444 1.477 1.00 10.00 N ATOM 366 CA LYS A 25 -19.039 -15.015 0.284 1.00 10.00 C ATOM 367 C LYS A 25 -17.941 -15.286 -0.757 1.00 10.00 C ATOM 368 O LYS A 25 -16.795 -14.879 -0.578 1.00 10.00 O ATOM 369 CB LYS A 25 -20.107 -14.027 -0.251 1.00 10.00 C ATOM 370 CG LYS A 25 -21.489 -14.646 -0.503 1.00 10.00 C ATOM 371 CD LYS A 25 -21.600 -15.444 -1.809 1.00 10.00 C ATOM 372 CE LYS A 25 -23.064 -15.833 -2.018 1.00 10.00 C ATOM 373 NZ LYS A 25 -23.296 -16.393 -3.370 1.00 10.00 N ATOM 0 H LYS A 25 -17.458 -14.122 1.273 1.00 10.00 H new ATOM 0 HA LYS A 25 -19.544 -15.953 0.515 1.00 10.00 H new ATOM 0 HB2 LYS A 25 -20.215 -13.210 0.462 1.00 10.00 H new ATOM 0 HB3 LYS A 25 -19.744 -13.591 -1.182 1.00 10.00 H new ATOM 0 HG2 LYS A 25 -21.737 -15.302 0.331 1.00 10.00 H new ATOM 0 HG3 LYS A 25 -22.233 -13.850 -0.514 1.00 10.00 H new ATOM 0 HD2 LYS A 25 -21.243 -14.848 -2.649 1.00 10.00 H new ATOM 0 HD3 LYS A 25 -20.974 -16.335 -1.762 1.00 10.00 H new ATOM 0 HE2 LYS A 25 -23.357 -16.566 -1.266 1.00 10.00 H new ATOM 0 HE3 LYS A 25 -23.697 -14.958 -1.873 1.00 10.00 H new ATOM 0 HZ1 LYS A 25 -24.300 -16.645 -3.474 1.00 10.00 H new ATOM 0 HZ2 LYS A 25 -23.041 -15.685 -4.088 1.00 10.00 H new ATOM 0 HZ3 LYS A 25 -22.711 -17.243 -3.499 1.00 10.00 H new ATOM 387 N HIS A 26 -18.288 -15.969 -1.842 1.00 10.00 N ATOM 388 CA HIS A 26 -17.371 -16.431 -2.880 1.00 10.00 C ATOM 389 C HIS A 26 -18.147 -16.583 -4.194 1.00 10.00 C ATOM 390 O HIS A 26 -19.075 -17.395 -4.272 1.00 10.00 O ATOM 391 CB HIS A 26 -16.725 -17.760 -2.431 1.00 10.00 C ATOM 392 CG HIS A 26 -17.653 -18.712 -1.711 1.00 10.00 C ATOM 393 ND1 HIS A 26 -18.830 -19.204 -2.221 1.00 10.00 N ATOM 394 CD2 HIS A 26 -17.532 -19.167 -0.425 1.00 10.00 C ATOM 395 CE1 HIS A 26 -19.413 -19.946 -1.264 1.00 10.00 C ATOM 396 NE2 HIS A 26 -18.665 -19.938 -0.151 1.00 10.00 N ATOM 0 H HIS A 26 -19.256 -16.227 -2.031 1.00 10.00 H new ATOM 0 HA HIS A 26 -16.569 -15.711 -3.042 1.00 10.00 H new ATOM 0 HB2 HIS A 26 -16.321 -18.265 -3.309 1.00 10.00 H new ATOM 0 HB3 HIS A 26 -15.882 -17.534 -1.777 1.00 10.00 H new ATOM 0 HD1 HIS A 26 -19.196 -19.036 -3.158 1.00 10.00 H new ATOM 0 HD2 HIS A 26 -16.714 -18.967 0.251 1.00 10.00 H new ATOM 0 HE1 HIS A 26 -20.349 -20.473 -1.375 1.00 10.00 H new ATOM 404 N LYS A 27 -17.805 -15.780 -5.210 1.00 10.00 N ATOM 405 CA LYS A 27 -18.401 -15.882 -6.548 1.00 10.00 C ATOM 406 C LYS A 27 -17.355 -15.569 -7.611 1.00 10.00 C ATOM 407 O LYS A 27 -16.675 -14.551 -7.546 1.00 10.00 O ATOM 408 CB LYS A 27 -19.682 -15.031 -6.644 1.00 10.00 C ATOM 409 CG LYS A 27 -19.531 -13.498 -6.607 1.00 10.00 C ATOM 410 CD LYS A 27 -19.337 -12.853 -7.992 1.00 10.00 C ATOM 411 CE LYS A 27 -20.042 -11.494 -8.037 1.00 10.00 C ATOM 412 NZ LYS A 27 -19.598 -10.694 -9.199 1.00 10.00 N ATOM 0 H LYS A 27 -17.107 -15.041 -5.127 1.00 10.00 H new ATOM 0 HA LYS A 27 -18.724 -16.906 -6.735 1.00 10.00 H new ATOM 0 HB2 LYS A 27 -20.191 -15.295 -7.571 1.00 10.00 H new ATOM 0 HB3 LYS A 27 -20.340 -15.323 -5.825 1.00 10.00 H new ATOM 0 HG2 LYS A 27 -20.416 -13.067 -6.138 1.00 10.00 H new ATOM 0 HG3 LYS A 27 -18.680 -13.242 -5.976 1.00 10.00 H new ATOM 0 HD2 LYS A 27 -18.274 -12.728 -8.199 1.00 10.00 H new ATOM 0 HD3 LYS A 27 -19.738 -13.507 -8.767 1.00 10.00 H new ATOM 0 HE2 LYS A 27 -21.121 -11.643 -8.087 1.00 10.00 H new ATOM 0 HE3 LYS A 27 -19.838 -10.946 -7.117 1.00 10.00 H new ATOM 0 HZ1 LYS A 27 -20.366 -10.060 -9.498 1.00 10.00 H new ATOM 0 HZ2 LYS A 27 -18.766 -10.129 -8.934 1.00 10.00 H new ATOM 0 HZ3 LYS A 27 -19.349 -11.330 -9.983 1.00 10.00 H new ATOM 426 N THR A 28 -17.160 -16.501 -8.543 1.00 10.00 N ATOM 427 CA THR A 28 -16.044 -16.567 -9.506 1.00 10.00 C ATOM 428 C THR A 28 -14.625 -16.574 -8.888 1.00 10.00 C ATOM 429 O THR A 28 -13.730 -17.096 -9.535 1.00 10.00 O ATOM 430 CB THR A 28 -16.213 -15.488 -10.600 1.00 10.00 C ATOM 431 OG1 THR A 28 -17.533 -15.502 -11.103 1.00 10.00 O ATOM 432 CG2 THR A 28 -15.312 -15.700 -11.819 1.00 10.00 C ATOM 0 H THR A 28 -17.810 -17.278 -8.659 1.00 10.00 H new ATOM 0 HA THR A 28 -16.112 -17.553 -9.966 1.00 10.00 H new ATOM 0 HB THR A 28 -15.951 -14.551 -10.108 1.00 10.00 H new ATOM 0 HG1 THR A 28 -17.627 -14.813 -11.794 1.00 10.00 H new ATOM 0 HG21 THR A 28 -15.487 -14.904 -12.543 1.00 10.00 H new ATOM 0 HG22 THR A 28 -14.268 -15.684 -11.507 1.00 10.00 H new ATOM 0 HG23 THR A 28 -15.539 -16.663 -12.276 1.00 10.00 H new ATOM 440 N GLY A 29 -14.411 -16.138 -7.638 1.00 10.00 N ATOM 441 CA GLY A 29 -13.228 -16.404 -6.809 1.00 10.00 C ATOM 442 C GLY A 29 -13.617 -16.826 -5.375 1.00 10.00 C ATOM 443 O GLY A 29 -14.765 -16.604 -4.975 1.00 10.00 O ATOM 0 H GLY A 29 -15.096 -15.559 -7.153 1.00 10.00 H new ATOM 0 HA2 GLY A 29 -12.630 -17.190 -7.270 1.00 10.00 H new ATOM 0 HA3 GLY A 29 -12.604 -15.511 -6.769 1.00 10.00 H new ATOM 447 N PRO A 30 -12.699 -17.420 -4.578 1.00 10.00 N ATOM 448 CA PRO A 30 -12.979 -17.837 -3.205 1.00 10.00 C ATOM 449 C PRO A 30 -12.894 -16.662 -2.215 1.00 10.00 C ATOM 450 O PRO A 30 -12.232 -15.657 -2.445 1.00 10.00 O ATOM 451 CB PRO A 30 -11.930 -18.904 -2.889 1.00 10.00 C ATOM 452 CG PRO A 30 -10.721 -18.458 -3.699 1.00 10.00 C ATOM 453 CD PRO A 30 -11.328 -17.770 -4.924 1.00 10.00 C ATOM 0 HA PRO A 30 -13.995 -18.219 -3.108 1.00 10.00 H new ATOM 0 HB2 PRO A 30 -11.707 -18.945 -1.823 1.00 10.00 H new ATOM 0 HB3 PRO A 30 -12.266 -19.898 -3.183 1.00 10.00 H new ATOM 0 HG2 PRO A 30 -10.089 -17.776 -3.130 1.00 10.00 H new ATOM 0 HG3 PRO A 30 -10.098 -19.305 -3.985 1.00 10.00 H new ATOM 0 HD2 PRO A 30 -10.758 -16.880 -5.189 1.00 10.00 H new ATOM 0 HD3 PRO A 30 -11.305 -18.432 -5.789 1.00 10.00 H new ATOM 461 N ASN A 31 -13.487 -16.843 -1.042 1.00 10.00 N ATOM 462 CA ASN A 31 -13.596 -15.946 0.114 1.00 10.00 C ATOM 463 C ASN A 31 -12.267 -15.601 0.832 1.00 10.00 C ATOM 464 O ASN A 31 -12.300 -15.065 1.938 1.00 10.00 O ATOM 465 CB ASN A 31 -14.591 -16.629 1.082 1.00 10.00 C ATOM 466 CG ASN A 31 -14.222 -18.078 1.371 1.00 10.00 C ATOM 467 OD1 ASN A 31 -14.294 -18.937 0.505 1.00 10.00 O ATOM 468 ND2 ASN A 31 -13.797 -18.407 2.564 1.00 10.00 N ATOM 0 H ASN A 31 -13.961 -17.726 -0.850 1.00 10.00 H new ATOM 0 HA ASN A 31 -13.935 -14.972 -0.239 1.00 10.00 H new ATOM 0 HB2 ASN A 31 -14.623 -16.072 2.018 1.00 10.00 H new ATOM 0 HB3 ASN A 31 -15.593 -16.591 0.655 1.00 10.00 H new ATOM 0 HD21 ASN A 31 -13.530 -19.371 2.762 1.00 10.00 H new ATOM 0 HD22 ASN A 31 -13.732 -17.699 3.296 1.00 10.00 H new ATOM 475 N LEU A 32 -11.112 -15.937 0.239 1.00 10.00 N ATOM 476 CA LEU A 32 -9.708 -15.850 0.687 1.00 10.00 C ATOM 477 C LEU A 32 -9.345 -16.436 2.075 1.00 10.00 C ATOM 478 O LEU A 32 -8.275 -17.029 2.201 1.00 10.00 O ATOM 479 CB LEU A 32 -9.182 -14.412 0.523 1.00 10.00 C ATOM 480 CG LEU A 32 -9.313 -13.780 -0.882 1.00 10.00 C ATOM 481 CD1 LEU A 32 -8.438 -12.525 -0.963 1.00 10.00 C ATOM 482 CD2 LEU A 32 -8.907 -14.686 -2.051 1.00 10.00 C ATOM 0 H LEU A 32 -11.144 -16.333 -0.700 1.00 10.00 H new ATOM 0 HA LEU A 32 -9.190 -16.536 0.017 1.00 10.00 H new ATOM 0 HB2 LEU A 32 -9.708 -13.774 1.233 1.00 10.00 H new ATOM 0 HB3 LEU A 32 -8.129 -14.401 0.804 1.00 10.00 H new ATOM 0 HG LEU A 32 -10.377 -13.572 -0.990 1.00 10.00 H new ATOM 0 HD11 LEU A 32 -8.531 -12.080 -1.954 1.00 10.00 H new ATOM 0 HD12 LEU A 32 -8.762 -11.806 -0.211 1.00 10.00 H new ATOM 0 HD13 LEU A 32 -7.397 -12.795 -0.782 1.00 10.00 H new ATOM 0 HD21 LEU A 32 -9.036 -14.148 -2.990 1.00 10.00 H new ATOM 0 HD22 LEU A 32 -7.862 -14.977 -1.940 1.00 10.00 H new ATOM 0 HD23 LEU A 32 -9.534 -15.578 -2.055 1.00 10.00 H new ATOM 494 N HIS A 33 -10.227 -16.392 3.082 1.00 10.00 N ATOM 495 CA HIS A 33 -10.107 -16.903 4.462 1.00 10.00 C ATOM 496 C HIS A 33 -8.686 -16.804 5.052 1.00 10.00 C ATOM 497 O HIS A 33 -7.983 -17.802 5.193 1.00 10.00 O ATOM 498 CB HIS A 33 -10.794 -18.281 4.665 1.00 10.00 C ATOM 499 CG HIS A 33 -10.730 -19.312 3.554 1.00 10.00 C ATOM 500 ND1 HIS A 33 -9.902 -19.298 2.457 1.00 10.00 N ATOM 501 CD2 HIS A 33 -11.638 -20.320 3.357 1.00 10.00 C ATOM 502 CE1 HIS A 33 -10.361 -20.203 1.579 1.00 10.00 C ATOM 503 NE2 HIS A 33 -11.399 -20.872 2.099 1.00 10.00 N ATOM 0 H HIS A 33 -11.137 -15.953 2.940 1.00 10.00 H new ATOM 0 HA HIS A 33 -10.685 -16.210 5.074 1.00 10.00 H new ATOM 0 HB2 HIS A 33 -10.363 -18.734 5.558 1.00 10.00 H new ATOM 0 HB3 HIS A 33 -11.846 -18.094 4.879 1.00 10.00 H new ATOM 0 HD1 HIS A 33 -9.082 -18.704 2.332 1.00 10.00 H new ATOM 0 HD2 HIS A 33 -12.403 -20.631 4.053 1.00 10.00 H new ATOM 0 HE1 HIS A 33 -9.952 -20.369 0.593 1.00 10.00 H new ATOM 511 N GLY A 34 -8.253 -15.578 5.384 1.00 10.00 N ATOM 512 CA GLY A 34 -6.950 -15.247 5.988 1.00 10.00 C ATOM 513 C GLY A 34 -5.752 -15.357 5.030 1.00 10.00 C ATOM 514 O GLY A 34 -4.830 -14.547 5.095 1.00 10.00 O ATOM 0 H GLY A 34 -8.828 -14.750 5.232 1.00 10.00 H new ATOM 0 HA2 GLY A 34 -6.994 -14.230 6.379 1.00 10.00 H new ATOM 0 HA3 GLY A 34 -6.780 -15.908 6.838 1.00 10.00 H new ATOM 518 N LEU A 35 -5.812 -16.324 4.110 1.00 10.00 N ATOM 519 CA LEU A 35 -4.947 -16.576 2.960 1.00 10.00 C ATOM 520 C LEU A 35 -3.464 -16.844 3.266 1.00 10.00 C ATOM 521 O LEU A 35 -2.969 -17.942 3.003 1.00 10.00 O ATOM 522 CB LEU A 35 -5.114 -15.456 1.922 1.00 10.00 C ATOM 523 CG LEU A 35 -4.792 -15.981 0.519 1.00 10.00 C ATOM 524 CD1 LEU A 35 -5.990 -16.639 -0.161 1.00 10.00 C ATOM 525 CD2 LEU A 35 -4.283 -14.831 -0.334 1.00 10.00 C ATOM 0 H LEU A 35 -6.551 -17.025 4.161 1.00 10.00 H new ATOM 0 HA LEU A 35 -5.292 -17.527 2.554 1.00 10.00 H new ATOM 0 HB2 LEU A 35 -6.135 -15.074 1.950 1.00 10.00 H new ATOM 0 HB3 LEU A 35 -4.455 -14.623 2.166 1.00 10.00 H new ATOM 0 HG LEU A 35 -4.030 -16.753 0.624 1.00 10.00 H new ATOM 0 HD11 LEU A 35 -5.699 -16.990 -1.151 1.00 10.00 H new ATOM 0 HD12 LEU A 35 -6.330 -17.484 0.438 1.00 10.00 H new ATOM 0 HD13 LEU A 35 -6.798 -15.914 -0.257 1.00 10.00 H new ATOM 0 HD21 LEU A 35 -4.051 -15.195 -1.335 1.00 10.00 H new ATOM 0 HD22 LEU A 35 -5.049 -14.058 -0.398 1.00 10.00 H new ATOM 0 HD23 LEU A 35 -3.383 -14.413 0.118 1.00 10.00 H new ATOM 537 N PHE A 36 -2.748 -15.826 3.742 1.00 10.00 N ATOM 538 CA PHE A 36 -1.304 -15.818 3.928 1.00 10.00 C ATOM 539 C PHE A 36 -0.888 -16.826 5.004 1.00 10.00 C ATOM 540 O PHE A 36 -1.257 -16.685 6.169 1.00 10.00 O ATOM 541 CB PHE A 36 -0.857 -14.395 4.287 1.00 10.00 C ATOM 542 CG PHE A 36 -0.986 -13.308 3.224 1.00 10.00 C ATOM 543 CD1 PHE A 36 -0.924 -13.601 1.848 1.00 10.00 C ATOM 544 CD2 PHE A 36 -1.036 -11.959 3.625 1.00 10.00 C ATOM 545 CE1 PHE A 36 -0.844 -12.567 0.903 1.00 10.00 C ATOM 546 CE2 PHE A 36 -0.969 -10.922 2.679 1.00 10.00 C ATOM 547 CZ PHE A 36 -0.872 -11.225 1.314 1.00 10.00 C ATOM 0 H PHE A 36 -3.182 -14.946 4.020 1.00 10.00 H new ATOM 0 HA PHE A 36 -0.813 -16.120 3.003 1.00 10.00 H new ATOM 0 HB2 PHE A 36 -1.428 -14.077 5.159 1.00 10.00 H new ATOM 0 HB3 PHE A 36 0.189 -14.441 4.590 1.00 10.00 H new ATOM 0 HD1 PHE A 36 -0.938 -14.629 1.518 1.00 10.00 H new ATOM 0 HD2 PHE A 36 -1.127 -11.718 4.674 1.00 10.00 H new ATOM 0 HE1 PHE A 36 -0.760 -12.805 -0.147 1.00 10.00 H new ATOM 0 HE2 PHE A 36 -0.992 -9.892 3.004 1.00 10.00 H new ATOM 0 HZ PHE A 36 -0.819 -10.431 0.583 1.00 10.00 H new ATOM 557 N GLY A 37 -0.147 -17.866 4.602 1.00 10.00 N ATOM 558 CA GLY A 37 0.275 -18.949 5.492 1.00 10.00 C ATOM 559 C GLY A 37 -0.761 -20.068 5.668 1.00 10.00 C ATOM 560 O GLY A 37 -0.492 -21.008 6.411 1.00 10.00 O ATOM 0 H GLY A 37 0.178 -17.978 3.642 1.00 10.00 H new ATOM 0 HA2 GLY A 37 1.197 -19.382 5.104 1.00 10.00 H new ATOM 0 HA3 GLY A 37 0.507 -18.529 6.471 1.00 10.00 H new ATOM 564 N ARG A 38 -1.918 -19.994 4.989 1.00 10.00 N ATOM 565 CA ARG A 38 -2.898 -21.087 4.889 1.00 10.00 C ATOM 566 C ARG A 38 -2.398 -22.095 3.842 1.00 10.00 C ATOM 567 O ARG A 38 -1.567 -22.938 4.156 1.00 10.00 O ATOM 568 CB ARG A 38 -4.290 -20.466 4.634 1.00 10.00 C ATOM 569 CG ARG A 38 -5.497 -21.412 4.477 1.00 10.00 C ATOM 570 CD ARG A 38 -6.763 -20.612 4.087 1.00 10.00 C ATOM 571 NE ARG A 38 -7.225 -20.835 2.697 1.00 10.00 N ATOM 572 CZ ARG A 38 -6.633 -20.481 1.560 1.00 10.00 C ATOM 573 NH1 ARG A 38 -5.510 -19.819 1.550 1.00 10.00 N ATOM 574 NH2 ARG A 38 -7.129 -20.789 0.387 1.00 10.00 N ATOM 0 H ARG A 38 -2.203 -19.155 4.484 1.00 10.00 H new ATOM 0 HA ARG A 38 -3.005 -21.664 5.808 1.00 10.00 H new ATOM 0 HB2 ARG A 38 -4.506 -19.786 5.458 1.00 10.00 H new ATOM 0 HB3 ARG A 38 -4.223 -19.861 3.730 1.00 10.00 H new ATOM 0 HG2 ARG A 38 -5.283 -22.161 3.714 1.00 10.00 H new ATOM 0 HG3 ARG A 38 -5.671 -21.948 5.410 1.00 10.00 H new ATOM 0 HD2 ARG A 38 -7.569 -20.875 4.771 1.00 10.00 H new ATOM 0 HD3 ARG A 38 -6.563 -19.549 4.224 1.00 10.00 H new ATOM 0 HE ARG A 38 -8.114 -21.325 2.599 1.00 10.00 H new ATOM 0 HH11 ARG A 38 -5.063 -19.560 2.429 1.00 10.00 H new ATOM 0 HH12 ARG A 38 -5.078 -19.561 0.663 1.00 10.00 H new ATOM 0 HH21 ARG A 38 -7.999 -21.318 0.324 1.00 10.00 H new ATOM 0 HH22 ARG A 38 -6.645 -20.499 -0.463 1.00 10.00 H new ATOM 588 N LYS A 39 -2.870 -21.987 2.595 1.00 10.00 N ATOM 589 CA LYS A 39 -2.451 -22.744 1.404 1.00 10.00 C ATOM 590 C LYS A 39 -2.793 -21.948 0.135 1.00 10.00 C ATOM 591 O LYS A 39 -3.503 -20.943 0.189 1.00 10.00 O ATOM 592 CB LYS A 39 -3.160 -24.122 1.348 1.00 10.00 C ATOM 593 CG LYS A 39 -2.708 -25.120 2.429 1.00 10.00 C ATOM 594 CD LYS A 39 -3.166 -26.559 2.155 1.00 10.00 C ATOM 595 CE LYS A 39 -2.381 -27.204 1.003 1.00 10.00 C ATOM 596 NZ LYS A 39 -2.889 -28.560 0.698 1.00 10.00 N ATOM 0 H LYS A 39 -3.609 -21.320 2.373 1.00 10.00 H new ATOM 0 HA LYS A 39 -1.374 -22.904 1.463 1.00 10.00 H new ATOM 0 HB2 LYS A 39 -4.235 -23.967 1.442 1.00 10.00 H new ATOM 0 HB3 LYS A 39 -2.987 -24.565 0.368 1.00 10.00 H new ATOM 0 HG2 LYS A 39 -1.621 -25.099 2.501 1.00 10.00 H new ATOM 0 HG3 LYS A 39 -3.098 -24.800 3.395 1.00 10.00 H new ATOM 0 HD2 LYS A 39 -3.042 -27.157 3.058 1.00 10.00 H new ATOM 0 HD3 LYS A 39 -4.229 -26.561 1.915 1.00 10.00 H new ATOM 0 HE2 LYS A 39 -2.455 -26.577 0.114 1.00 10.00 H new ATOM 0 HE3 LYS A 39 -1.325 -27.260 1.267 1.00 10.00 H new ATOM 0 HZ1 LYS A 39 -2.339 -28.969 -0.084 1.00 10.00 H new ATOM 0 HZ2 LYS A 39 -2.795 -29.163 1.540 1.00 10.00 H new ATOM 0 HZ3 LYS A 39 -3.890 -28.502 0.423 1.00 10.00 H new ATOM 610 N THR A 40 -2.381 -22.467 -1.019 1.00 10.00 N ATOM 611 CA THR A 40 -3.036 -22.227 -2.309 1.00 10.00 C ATOM 612 C THR A 40 -3.710 -23.543 -2.686 1.00 10.00 C ATOM 613 O THR A 40 -3.038 -24.461 -3.147 1.00 10.00 O ATOM 614 CB THR A 40 -2.016 -21.770 -3.356 1.00 10.00 C ATOM 615 OG1 THR A 40 -1.422 -20.577 -2.916 1.00 10.00 O ATOM 616 CG2 THR A 40 -2.624 -21.515 -4.730 1.00 10.00 C ATOM 0 H THR A 40 -1.567 -23.078 -1.089 1.00 10.00 H new ATOM 0 HA THR A 40 -3.774 -21.427 -2.253 1.00 10.00 H new ATOM 0 HB THR A 40 -1.294 -22.579 -3.464 1.00 10.00 H new ATOM 0 HG1 THR A 40 -2.097 -19.867 -2.887 1.00 10.00 H new ATOM 0 HG21 THR A 40 -1.843 -21.195 -5.420 1.00 10.00 H new ATOM 0 HG22 THR A 40 -3.082 -22.432 -5.101 1.00 10.00 H new ATOM 0 HG23 THR A 40 -3.382 -20.736 -4.653 1.00 10.00 H new ATOM 624 N GLY A 41 -5.003 -23.676 -2.365 1.00 10.00 N ATOM 625 CA GLY A 41 -5.691 -24.972 -2.344 1.00 10.00 C ATOM 626 C GLY A 41 -7.144 -24.871 -1.883 1.00 10.00 C ATOM 627 O GLY A 41 -8.088 -25.100 -2.642 1.00 10.00 O ATOM 0 H GLY A 41 -5.601 -22.889 -2.113 1.00 10.00 H new ATOM 0 HA2 GLY A 41 -5.662 -25.408 -3.342 1.00 10.00 H new ATOM 0 HA3 GLY A 41 -5.153 -25.652 -1.684 1.00 10.00 H new ATOM 631 N GLN A 42 -7.280 -24.507 -0.611 1.00 10.00 N ATOM 632 CA GLN A 42 -8.526 -24.475 0.163 1.00 10.00 C ATOM 633 C GLN A 42 -9.545 -23.453 -0.359 1.00 10.00 C ATOM 634 O GLN A 42 -9.210 -22.281 -0.540 1.00 10.00 O ATOM 635 CB GLN A 42 -8.201 -24.128 1.627 1.00 10.00 C ATOM 636 CG GLN A 42 -7.554 -25.265 2.423 1.00 10.00 C ATOM 637 CD GLN A 42 -8.534 -26.410 2.671 1.00 10.00 C ATOM 638 OE1 GLN A 42 -9.453 -26.295 3.465 1.00 10.00 O ATOM 639 NE2 GLN A 42 -8.395 -27.534 1.999 1.00 10.00 N ATOM 0 H GLN A 42 -6.478 -24.208 -0.056 1.00 10.00 H new ATOM 0 HA GLN A 42 -8.976 -25.463 0.068 1.00 10.00 H new ATOM 0 HB2 GLN A 42 -7.534 -23.266 1.643 1.00 10.00 H new ATOM 0 HB3 GLN A 42 -9.121 -23.829 2.129 1.00 10.00 H new ATOM 0 HG2 GLN A 42 -6.686 -25.640 1.881 1.00 10.00 H new ATOM 0 HG3 GLN A 42 -7.193 -24.882 3.377 1.00 10.00 H new ATOM 0 HE21 GLN A 42 -7.629 -27.639 1.333 1.00 10.00 H new ATOM 0 HE22 GLN A 42 -9.053 -28.300 2.144 1.00 10.00 H new ATOM 648 N ALA A 43 -10.804 -23.884 -0.477 1.00 10.00 N ATOM 649 CA ALA A 43 -12.013 -23.102 -0.727 1.00 10.00 C ATOM 650 C ALA A 43 -13.222 -23.995 -0.364 1.00 10.00 C ATOM 651 O ALA A 43 -13.121 -25.220 -0.494 1.00 10.00 O ATOM 652 CB ALA A 43 -12.073 -22.708 -2.206 1.00 10.00 C ATOM 0 H ALA A 43 -11.020 -24.877 -0.392 1.00 10.00 H new ATOM 0 HA ALA A 43 -12.020 -22.190 -0.130 1.00 10.00 H new ATOM 0 HB1 ALA A 43 -12.975 -22.125 -2.391 1.00 10.00 H new ATOM 0 HB2 ALA A 43 -11.197 -22.111 -2.459 1.00 10.00 H new ATOM 0 HB3 ALA A 43 -12.090 -23.607 -2.822 1.00 10.00 H new ATOM 658 N PRO A 44 -14.367 -23.438 0.072 1.00 10.00 N ATOM 659 CA PRO A 44 -15.531 -24.211 0.516 1.00 10.00 C ATOM 660 C PRO A 44 -16.346 -24.755 -0.675 1.00 10.00 C ATOM 661 O PRO A 44 -17.478 -24.346 -0.921 1.00 10.00 O ATOM 662 CB PRO A 44 -16.314 -23.244 1.413 1.00 10.00 C ATOM 663 CG PRO A 44 -16.045 -21.898 0.747 1.00 10.00 C ATOM 664 CD PRO A 44 -14.591 -22.019 0.304 1.00 10.00 C ATOM 0 HA PRO A 44 -15.257 -25.112 1.065 1.00 10.00 H new ATOM 0 HB2 PRO A 44 -17.378 -23.481 1.437 1.00 10.00 H new ATOM 0 HB3 PRO A 44 -15.959 -23.267 2.443 1.00 10.00 H new ATOM 0 HG2 PRO A 44 -16.711 -21.726 -0.098 1.00 10.00 H new ATOM 0 HG3 PRO A 44 -16.188 -21.069 1.440 1.00 10.00 H new ATOM 0 HD2 PRO A 44 -14.408 -21.441 -0.602 1.00 10.00 H new ATOM 0 HD3 PRO A 44 -13.915 -21.636 1.069 1.00 10.00 H new ATOM 672 N GLY A 45 -15.753 -25.673 -1.446 1.00 10.00 N ATOM 673 CA GLY A 45 -16.400 -26.342 -2.584 1.00 10.00 C ATOM 674 C GLY A 45 -16.586 -25.471 -3.836 1.00 10.00 C ATOM 675 O GLY A 45 -17.222 -25.909 -4.789 1.00 10.00 O ATOM 0 H GLY A 45 -14.792 -25.979 -1.295 1.00 10.00 H new ATOM 0 HA2 GLY A 45 -15.809 -27.217 -2.854 1.00 10.00 H new ATOM 0 HA3 GLY A 45 -17.377 -26.704 -2.264 1.00 10.00 H new ATOM 679 N PHE A 46 -16.034 -24.253 -3.846 1.00 10.00 N ATOM 680 CA PHE A 46 -16.081 -23.317 -4.971 1.00 10.00 C ATOM 681 C PHE A 46 -15.331 -23.879 -6.196 1.00 10.00 C ATOM 682 O PHE A 46 -14.134 -24.167 -6.144 1.00 10.00 O ATOM 683 CB PHE A 46 -15.539 -21.952 -4.504 1.00 10.00 C ATOM 684 CG PHE A 46 -14.818 -21.141 -5.559 1.00 10.00 C ATOM 685 CD1 PHE A 46 -15.529 -20.479 -6.574 1.00 10.00 C ATOM 686 CD2 PHE A 46 -13.417 -21.106 -5.555 1.00 10.00 C ATOM 687 CE1 PHE A 46 -14.822 -19.816 -7.593 1.00 10.00 C ATOM 688 CE2 PHE A 46 -12.722 -20.403 -6.548 1.00 10.00 C ATOM 689 CZ PHE A 46 -13.421 -19.774 -7.583 1.00 10.00 C ATOM 0 H PHE A 46 -15.526 -23.881 -3.044 1.00 10.00 H new ATOM 0 HA PHE A 46 -17.111 -23.177 -5.299 1.00 10.00 H new ATOM 0 HB2 PHE A 46 -16.372 -21.361 -4.123 1.00 10.00 H new ATOM 0 HB3 PHE A 46 -14.858 -22.118 -3.669 1.00 10.00 H new ATOM 0 HD1 PHE A 46 -16.609 -20.479 -6.572 1.00 10.00 H new ATOM 0 HD2 PHE A 46 -12.870 -21.624 -4.782 1.00 10.00 H new ATOM 0 HE1 PHE A 46 -15.365 -19.334 -8.392 1.00 10.00 H new ATOM 0 HE2 PHE A 46 -11.644 -20.347 -6.514 1.00 10.00 H new ATOM 0 HZ PHE A 46 -12.886 -19.260 -8.368 1.00 10.00 H new ATOM 699 N THR A 47 -16.062 -24.049 -7.303 1.00 10.00 N ATOM 700 CA THR A 47 -15.609 -24.662 -8.558 1.00 10.00 C ATOM 701 C THR A 47 -14.614 -23.788 -9.332 1.00 10.00 C ATOM 702 O THR A 47 -14.974 -23.077 -10.270 1.00 10.00 O ATOM 703 CB THR A 47 -16.823 -24.996 -9.441 1.00 10.00 C ATOM 704 OG1 THR A 47 -17.825 -25.633 -8.680 1.00 10.00 O ATOM 705 CG2 THR A 47 -16.477 -25.942 -10.594 1.00 10.00 C ATOM 0 H THR A 47 -17.035 -23.748 -7.351 1.00 10.00 H new ATOM 0 HA THR A 47 -15.076 -25.575 -8.292 1.00 10.00 H new ATOM 0 HB THR A 47 -17.164 -24.043 -9.844 1.00 10.00 H new ATOM 0 HG1 THR A 47 -18.592 -25.838 -9.255 1.00 10.00 H new ATOM 0 HG21 THR A 47 -17.373 -26.142 -11.182 1.00 10.00 H new ATOM 0 HG22 THR A 47 -15.721 -25.480 -11.229 1.00 10.00 H new ATOM 0 HG23 THR A 47 -16.090 -26.879 -10.193 1.00 10.00 H new ATOM 713 N TYR A 48 -13.345 -23.871 -8.943 1.00 10.00 N ATOM 714 CA TYR A 48 -12.196 -23.302 -9.646 1.00 10.00 C ATOM 715 C TYR A 48 -11.615 -24.223 -10.746 1.00 10.00 C ATOM 716 O TYR A 48 -12.149 -25.294 -11.031 1.00 10.00 O ATOM 717 CB TYR A 48 -11.161 -22.914 -8.578 1.00 10.00 C ATOM 718 CG TYR A 48 -10.900 -23.888 -7.431 1.00 10.00 C ATOM 719 CD1 TYR A 48 -10.715 -25.269 -7.651 1.00 10.00 C ATOM 720 CD2 TYR A 48 -10.748 -23.375 -6.127 1.00 10.00 C ATOM 721 CE1 TYR A 48 -10.300 -26.107 -6.599 1.00 10.00 C ATOM 722 CE2 TYR A 48 -10.298 -24.199 -5.078 1.00 10.00 C ATOM 723 CZ TYR A 48 -10.062 -25.570 -5.314 1.00 10.00 C ATOM 724 OH TYR A 48 -9.564 -26.366 -4.331 1.00 10.00 O ATOM 0 H TYR A 48 -13.076 -24.359 -8.089 1.00 10.00 H new ATOM 0 HA TYR A 48 -12.512 -22.422 -10.205 1.00 10.00 H new ATOM 0 HB2 TYR A 48 -10.212 -22.736 -9.084 1.00 10.00 H new ATOM 0 HB3 TYR A 48 -11.473 -21.965 -8.143 1.00 10.00 H new ATOM 0 HD1 TYR A 48 -10.893 -25.685 -8.632 1.00 10.00 H new ATOM 0 HD2 TYR A 48 -10.979 -22.339 -5.930 1.00 10.00 H new ATOM 0 HE1 TYR A 48 -10.163 -27.164 -6.775 1.00 10.00 H new ATOM 0 HE2 TYR A 48 -10.134 -23.783 -4.095 1.00 10.00 H new ATOM 0 HH TYR A 48 -9.372 -25.824 -3.537 1.00 10.00 H new ATOM 734 N THR A 49 -10.477 -23.814 -11.327 1.00 10.00 N ATOM 735 CA THR A 49 -9.614 -24.618 -12.218 1.00 10.00 C ATOM 736 C THR A 49 -9.035 -25.844 -11.490 1.00 10.00 C ATOM 737 O THR A 49 -9.125 -25.942 -10.270 1.00 10.00 O ATOM 738 CB THR A 49 -8.443 -23.724 -12.693 1.00 10.00 C ATOM 739 OG1 THR A 49 -7.577 -24.387 -13.577 1.00 10.00 O ATOM 740 CG2 THR A 49 -7.521 -23.265 -11.560 1.00 10.00 C ATOM 0 H THR A 49 -10.113 -22.872 -11.185 1.00 10.00 H new ATOM 0 HA THR A 49 -10.213 -24.972 -13.057 1.00 10.00 H new ATOM 0 HB THR A 49 -8.960 -22.885 -13.159 1.00 10.00 H new ATOM 0 HG1 THR A 49 -7.184 -23.738 -14.198 1.00 10.00 H new ATOM 0 HG21 THR A 49 -6.724 -22.643 -11.968 1.00 10.00 H new ATOM 0 HG22 THR A 49 -8.095 -22.689 -10.834 1.00 10.00 H new ATOM 0 HG23 THR A 49 -7.086 -24.136 -11.070 1.00 10.00 H new ATOM 748 N ASP A 50 -8.360 -26.752 -12.191 1.00 10.00 N ATOM 749 CA ASP A 50 -7.337 -27.630 -11.621 1.00 10.00 C ATOM 750 C ASP A 50 -6.009 -26.866 -11.365 1.00 10.00 C ATOM 751 O ASP A 50 -5.748 -26.458 -10.221 1.00 10.00 O ATOM 752 CB ASP A 50 -7.191 -28.872 -12.523 1.00 10.00 C ATOM 753 CG ASP A 50 -7.059 -28.509 -14.005 1.00 10.00 C ATOM 754 OD1 ASP A 50 -8.104 -28.213 -14.624 1.00 10.00 O ATOM 755 OD2 ASP A 50 -5.897 -28.403 -14.452 1.00 10.00 O ATOM 0 H ASP A 50 -8.510 -26.902 -13.189 1.00 10.00 H new ATOM 0 HA ASP A 50 -7.642 -27.979 -10.635 1.00 10.00 H new ATOM 0 HB2 ASP A 50 -6.315 -29.441 -12.212 1.00 10.00 H new ATOM 0 HB3 ASP A 50 -8.057 -29.520 -12.387 1.00 10.00 H new ATOM 760 N ALA A 51 -5.199 -26.674 -12.421 1.00 10.00 N ATOM 761 CA ALA A 51 -3.790 -26.272 -12.502 1.00 10.00 C ATOM 762 C ALA A 51 -3.417 -24.935 -11.833 1.00 10.00 C ATOM 763 O ALA A 51 -2.977 -23.973 -12.466 1.00 10.00 O ATOM 764 CB ALA A 51 -3.355 -26.331 -13.974 1.00 10.00 C ATOM 0 H ALA A 51 -5.571 -26.817 -13.360 1.00 10.00 H new ATOM 0 HA ALA A 51 -3.230 -26.987 -11.899 1.00 10.00 H new ATOM 0 HB1 ALA A 51 -2.309 -26.035 -14.056 1.00 10.00 H new ATOM 0 HB2 ALA A 51 -3.475 -27.348 -14.349 1.00 10.00 H new ATOM 0 HB3 ALA A 51 -3.971 -25.652 -14.563 1.00 10.00 H new ATOM 770 N ASN A 52 -3.480 -24.956 -10.506 1.00 10.00 N ATOM 771 CA ASN A 52 -3.002 -23.939 -9.584 1.00 10.00 C ATOM 772 C ASN A 52 -2.870 -24.595 -8.193 1.00 10.00 C ATOM 773 O ASN A 52 -1.770 -24.918 -7.740 1.00 10.00 O ATOM 774 CB ASN A 52 -3.967 -22.730 -9.604 1.00 10.00 C ATOM 775 CG ASN A 52 -3.715 -21.744 -8.469 1.00 10.00 C ATOM 776 OD1 ASN A 52 -2.677 -21.751 -7.831 1.00 10.00 O ATOM 777 ND2 ASN A 52 -4.680 -20.908 -8.147 1.00 10.00 N ATOM 0 H ASN A 52 -3.898 -25.745 -10.013 1.00 10.00 H new ATOM 0 HA ASN A 52 -2.024 -23.552 -9.870 1.00 10.00 H new ATOM 0 HB2 ASN A 52 -3.869 -22.210 -10.557 1.00 10.00 H new ATOM 0 HB3 ASN A 52 -4.994 -23.091 -9.542 1.00 10.00 H new ATOM 0 HD21 ASN A 52 -4.559 -20.266 -7.364 1.00 10.00 H new ATOM 0 HD22 ASN A 52 -5.549 -20.902 -8.681 1.00 10.00 H new ATOM 784 N LYS A 53 -4.025 -24.895 -7.582 1.00 10.00 N ATOM 785 CA LYS A 53 -4.220 -25.529 -6.265 1.00 10.00 C ATOM 786 C LYS A 53 -3.478 -26.868 -6.179 1.00 10.00 C ATOM 787 O LYS A 53 -2.889 -27.183 -5.153 1.00 10.00 O ATOM 788 CB LYS A 53 -5.725 -25.724 -6.018 1.00 10.00 C ATOM 789 CG LYS A 53 -6.494 -24.420 -5.681 1.00 10.00 C ATOM 790 CD LYS A 53 -6.615 -23.309 -6.737 1.00 10.00 C ATOM 791 CE LYS A 53 -7.602 -23.542 -7.884 1.00 10.00 C ATOM 792 NZ LYS A 53 -7.583 -24.920 -8.420 1.00 10.00 N ATOM 0 H LYS A 53 -4.918 -24.685 -8.028 1.00 10.00 H new ATOM 0 HA LYS A 53 -3.807 -24.879 -5.494 1.00 10.00 H new ATOM 0 HB2 LYS A 53 -6.171 -26.175 -6.905 1.00 10.00 H new ATOM 0 HB3 LYS A 53 -5.858 -26.431 -5.199 1.00 10.00 H new ATOM 0 HG2 LYS A 53 -7.506 -24.705 -5.391 1.00 10.00 H new ATOM 0 HG3 LYS A 53 -6.022 -23.982 -4.801 1.00 10.00 H new ATOM 0 HD2 LYS A 53 -6.899 -22.388 -6.228 1.00 10.00 H new ATOM 0 HD3 LYS A 53 -5.628 -23.143 -7.168 1.00 10.00 H new ATOM 0 HE2 LYS A 53 -8.609 -23.312 -7.536 1.00 10.00 H new ATOM 0 HE3 LYS A 53 -7.377 -22.845 -8.691 1.00 10.00 H new ATOM 0 HZ1 LYS A 53 -8.226 -24.984 -9.235 1.00 10.00 H new ATOM 0 HZ2 LYS A 53 -6.617 -25.162 -8.720 1.00 10.00 H new ATOM 0 HZ3 LYS A 53 -7.893 -25.584 -7.682 1.00 10.00 H new ATOM 806 N ASN A 54 -3.462 -27.622 -7.286 1.00 10.00 N ATOM 807 CA ASN A 54 -2.741 -28.886 -7.417 1.00 10.00 C ATOM 808 C ASN A 54 -1.217 -28.736 -7.245 1.00 10.00 C ATOM 809 O ASN A 54 -0.592 -29.623 -6.668 1.00 10.00 O ATOM 810 CB ASN A 54 -3.101 -29.504 -8.778 1.00 10.00 C ATOM 811 CG ASN A 54 -2.622 -30.944 -8.881 1.00 10.00 C ATOM 812 OD1 ASN A 54 -3.214 -31.848 -8.319 1.00 10.00 O ATOM 813 ND2 ASN A 54 -1.550 -31.206 -9.603 1.00 10.00 N ATOM 0 H ASN A 54 -3.964 -27.359 -8.134 1.00 10.00 H new ATOM 0 HA ASN A 54 -3.050 -29.549 -6.609 1.00 10.00 H new ATOM 0 HB2 ASN A 54 -4.181 -29.468 -8.921 1.00 10.00 H new ATOM 0 HB3 ASN A 54 -2.654 -28.913 -9.577 1.00 10.00 H new ATOM 0 HD21 ASN A 54 -1.216 -32.166 -9.691 1.00 10.00 H new ATOM 0 HD22 ASN A 54 -1.054 -30.449 -10.074 1.00 10.00 H new ATOM 820 N LYS A 55 -0.607 -27.644 -7.742 1.00 10.00 N ATOM 821 CA LYS A 55 0.798 -27.320 -7.451 1.00 10.00 C ATOM 822 C LYS A 55 0.972 -26.734 -6.053 1.00 10.00 C ATOM 823 O LYS A 55 1.892 -27.141 -5.345 1.00 10.00 O ATOM 824 CB LYS A 55 1.412 -26.413 -8.536 1.00 10.00 C ATOM 825 CG LYS A 55 2.936 -26.247 -8.339 1.00 10.00 C ATOM 826 CD LYS A 55 3.348 -25.003 -7.526 1.00 10.00 C ATOM 827 CE LYS A 55 4.595 -25.239 -6.657 1.00 10.00 C ATOM 828 NZ LYS A 55 4.274 -25.883 -5.357 1.00 10.00 N ATOM 0 H LYS A 55 -1.070 -26.969 -8.350 1.00 10.00 H new ATOM 0 HA LYS A 55 1.351 -28.259 -7.469 1.00 10.00 H new ATOM 0 HB2 LYS A 55 1.215 -26.837 -9.521 1.00 10.00 H new ATOM 0 HB3 LYS A 55 0.932 -25.435 -8.509 1.00 10.00 H new ATOM 0 HG2 LYS A 55 3.323 -27.135 -7.840 1.00 10.00 H new ATOM 0 HG3 LYS A 55 3.412 -26.199 -9.318 1.00 10.00 H new ATOM 0 HD2 LYS A 55 3.540 -24.176 -8.210 1.00 10.00 H new ATOM 0 HD3 LYS A 55 2.518 -24.702 -6.887 1.00 10.00 H new ATOM 0 HE2 LYS A 55 5.301 -25.865 -7.203 1.00 10.00 H new ATOM 0 HE3 LYS A 55 5.090 -24.286 -6.473 1.00 10.00 H new ATOM 0 HZ1 LYS A 55 5.145 -26.263 -4.933 1.00 10.00 H new ATOM 0 HZ2 LYS A 55 3.855 -25.180 -4.715 1.00 10.00 H new ATOM 0 HZ3 LYS A 55 3.597 -26.658 -5.511 1.00 10.00 H new ATOM 842 N GLY A 56 0.167 -25.722 -5.707 1.00 10.00 N ATOM 843 CA GLY A 56 0.250 -24.979 -4.450 1.00 10.00 C ATOM 844 C GLY A 56 1.527 -24.134 -4.324 1.00 10.00 C ATOM 845 O GLY A 56 2.503 -24.570 -3.716 1.00 10.00 O ATOM 0 H GLY A 56 -0.582 -25.390 -6.315 1.00 10.00 H new ATOM 0 HA2 GLY A 56 -0.619 -24.326 -4.364 1.00 10.00 H new ATOM 0 HA3 GLY A 56 0.204 -25.681 -3.618 1.00 10.00 H new ATOM 849 N ILE A 57 1.560 -22.930 -4.913 1.00 10.00 N ATOM 850 CA ILE A 57 2.632 -21.931 -4.684 1.00 10.00 C ATOM 851 C ILE A 57 2.661 -21.372 -3.240 1.00 10.00 C ATOM 852 O ILE A 57 3.686 -20.844 -2.788 1.00 10.00 O ATOM 853 CB ILE A 57 2.604 -20.809 -5.762 1.00 10.00 C ATOM 854 CG1 ILE A 57 1.218 -20.217 -6.113 1.00 10.00 C ATOM 855 CG2 ILE A 57 3.207 -21.359 -7.067 1.00 10.00 C ATOM 856 CD1 ILE A 57 0.663 -19.256 -5.067 1.00 10.00 C ATOM 0 H ILE A 57 0.843 -22.613 -5.566 1.00 10.00 H new ATOM 0 HA ILE A 57 3.576 -22.465 -4.795 1.00 10.00 H new ATOM 0 HB ILE A 57 3.173 -19.994 -5.315 1.00 10.00 H new ATOM 0 HG12 ILE A 57 1.290 -19.695 -7.067 1.00 10.00 H new ATOM 0 HG13 ILE A 57 0.511 -21.035 -6.250 1.00 10.00 H new ATOM 0 HG21 ILE A 57 3.193 -20.581 -7.831 1.00 10.00 H new ATOM 0 HG22 ILE A 57 4.235 -21.673 -6.888 1.00 10.00 H new ATOM 0 HG23 ILE A 57 2.621 -22.212 -7.407 1.00 10.00 H new ATOM 0 HD11 ILE A 57 -0.310 -18.888 -5.391 1.00 10.00 H new ATOM 0 HD12 ILE A 57 0.555 -19.777 -4.115 1.00 10.00 H new ATOM 0 HD13 ILE A 57 1.347 -18.416 -4.946 1.00 10.00 H new ATOM 868 N THR A 58 1.555 -21.566 -2.509 1.00 10.00 N ATOM 869 CA THR A 58 1.182 -20.987 -1.213 1.00 10.00 C ATOM 870 C THR A 58 1.191 -19.454 -1.206 1.00 10.00 C ATOM 871 O THR A 58 2.122 -18.787 -1.658 1.00 10.00 O ATOM 872 CB THR A 58 1.972 -21.642 -0.068 1.00 10.00 C ATOM 873 OG1 THR A 58 1.521 -22.974 0.048 1.00 10.00 O ATOM 874 CG2 THR A 58 1.754 -21.000 1.302 1.00 10.00 C ATOM 0 H THR A 58 0.827 -22.196 -2.845 1.00 10.00 H new ATOM 0 HA THR A 58 0.135 -21.230 -1.032 1.00 10.00 H new ATOM 0 HB THR A 58 3.027 -21.536 -0.321 1.00 10.00 H new ATOM 0 HG1 THR A 58 2.008 -23.422 0.771 1.00 10.00 H new ATOM 0 HG21 THR A 58 2.349 -21.525 2.049 1.00 10.00 H new ATOM 0 HG22 THR A 58 2.058 -19.954 1.266 1.00 10.00 H new ATOM 0 HG23 THR A 58 0.699 -21.062 1.569 1.00 10.00 H new ATOM 882 N TRP A 59 0.105 -18.864 -0.710 1.00 10.00 N ATOM 883 CA TRP A 59 0.024 -17.441 -0.397 1.00 10.00 C ATOM 884 C TRP A 59 0.742 -17.115 0.919 1.00 10.00 C ATOM 885 O TRP A 59 0.738 -17.909 1.861 1.00 10.00 O ATOM 886 CB TRP A 59 -1.441 -17.028 -0.405 1.00 10.00 C ATOM 887 CG TRP A 59 -2.161 -17.453 -1.651 1.00 10.00 C ATOM 888 CD1 TRP A 59 -3.207 -18.306 -1.681 1.00 10.00 C ATOM 889 CD2 TRP A 59 -1.879 -17.114 -3.048 1.00 10.00 C ATOM 890 NE1 TRP A 59 -3.580 -18.538 -2.985 1.00 10.00 N ATOM 891 CE2 TRP A 59 -2.816 -17.811 -3.867 1.00 10.00 C ATOM 892 CE3 TRP A 59 -0.935 -16.299 -3.716 1.00 10.00 C ATOM 893 CZ2 TRP A 59 -2.847 -17.689 -5.260 1.00 10.00 C ATOM 894 CZ3 TRP A 59 -0.956 -16.174 -5.120 1.00 10.00 C ATOM 895 CH2 TRP A 59 -1.916 -16.852 -5.885 1.00 10.00 C ATOM 0 H TRP A 59 -0.757 -19.371 -0.511 1.00 10.00 H new ATOM 0 HA TRP A 59 0.546 -16.857 -1.155 1.00 10.00 H new ATOM 0 HB2 TRP A 59 -1.940 -17.461 0.462 1.00 10.00 H new ATOM 0 HB3 TRP A 59 -1.508 -15.945 -0.304 1.00 10.00 H new ATOM 0 HD1 TRP A 59 -3.680 -18.741 -0.813 1.00 10.00 H new ATOM 0 HE1 TRP A 59 -4.330 -19.171 -3.263 1.00 10.00 H new ATOM 0 HE3 TRP A 59 -0.190 -15.767 -3.144 1.00 10.00 H new ATOM 0 HZ2 TRP A 59 -3.577 -18.231 -5.843 1.00 10.00 H new ATOM 0 HZ3 TRP A 59 -0.225 -15.549 -5.612 1.00 10.00 H new ATOM 0 HH2 TRP A 59 -1.937 -16.728 -6.958 1.00 10.00 H new ATOM 906 N LYS A 60 1.333 -15.919 0.991 1.00 10.00 N ATOM 907 CA LYS A 60 2.236 -15.477 2.070 1.00 10.00 C ATOM 908 C LYS A 60 2.404 -13.954 2.054 1.00 10.00 C ATOM 909 O LYS A 60 2.131 -13.313 3.059 1.00 10.00 O ATOM 910 CB LYS A 60 3.582 -16.243 2.003 1.00 10.00 C ATOM 911 CG LYS A 60 4.459 -16.011 0.752 1.00 10.00 C ATOM 912 CD LYS A 60 5.385 -17.195 0.412 1.00 10.00 C ATOM 913 CE LYS A 60 4.544 -18.327 -0.190 1.00 10.00 C ATOM 914 NZ LYS A 60 5.320 -19.322 -0.970 1.00 10.00 N ATOM 0 H LYS A 60 1.194 -15.203 0.277 1.00 10.00 H new ATOM 0 HA LYS A 60 1.788 -15.722 3.033 1.00 10.00 H new ATOM 0 HB2 LYS A 60 4.168 -15.976 2.882 1.00 10.00 H new ATOM 0 HB3 LYS A 60 3.369 -17.310 2.074 1.00 10.00 H new ATOM 0 HG2 LYS A 60 3.812 -15.812 -0.102 1.00 10.00 H new ATOM 0 HG3 LYS A 60 5.067 -15.119 0.906 1.00 10.00 H new ATOM 0 HD2 LYS A 60 6.154 -16.881 -0.293 1.00 10.00 H new ATOM 0 HD3 LYS A 60 5.897 -17.542 1.309 1.00 10.00 H new ATOM 0 HE2 LYS A 60 4.022 -18.843 0.616 1.00 10.00 H new ATOM 0 HE3 LYS A 60 3.782 -17.892 -0.836 1.00 10.00 H new ATOM 0 HZ1 LYS A 60 4.684 -19.827 -1.619 1.00 10.00 H new ATOM 0 HZ2 LYS A 60 6.058 -18.835 -1.518 1.00 10.00 H new ATOM 0 HZ3 LYS A 60 5.763 -20.003 -0.321 1.00 10.00 H new ATOM 928 N GLU A 61 2.744 -13.423 0.874 1.00 10.00 N ATOM 929 CA GLU A 61 2.693 -12.029 0.407 1.00 10.00 C ATOM 930 C GLU A 61 3.386 -11.922 -0.959 1.00 10.00 C ATOM 931 O GLU A 61 2.744 -11.566 -1.946 1.00 10.00 O ATOM 932 CB GLU A 61 3.191 -10.992 1.436 1.00 10.00 C ATOM 933 CG GLU A 61 4.543 -11.233 2.119 1.00 10.00 C ATOM 934 CD GLU A 61 4.745 -10.163 3.200 1.00 10.00 C ATOM 935 OE1 GLU A 61 5.151 -9.042 2.820 1.00 10.00 O ATOM 936 OE2 GLU A 61 4.440 -10.458 4.379 1.00 10.00 O ATOM 0 H GLU A 61 3.103 -14.029 0.137 1.00 10.00 H new ATOM 0 HA GLU A 61 1.643 -11.762 0.284 1.00 10.00 H new ATOM 0 HB2 GLU A 61 3.240 -10.025 0.936 1.00 10.00 H new ATOM 0 HB3 GLU A 61 2.435 -10.909 2.217 1.00 10.00 H new ATOM 0 HG2 GLU A 61 4.570 -12.228 2.563 1.00 10.00 H new ATOM 0 HG3 GLU A 61 5.350 -11.188 1.387 1.00 10.00 H new ATOM 943 N GLU A 62 4.648 -12.359 -1.035 1.00 10.00 N ATOM 944 CA GLU A 62 5.499 -12.414 -2.235 1.00 10.00 C ATOM 945 C GLU A 62 4.755 -12.974 -3.458 1.00 10.00 C ATOM 946 O GLU A 62 4.681 -12.352 -4.519 1.00 10.00 O ATOM 947 CB GLU A 62 6.712 -13.322 -1.948 1.00 10.00 C ATOM 948 CG GLU A 62 7.545 -12.968 -0.707 1.00 10.00 C ATOM 949 CD GLU A 62 8.474 -14.137 -0.363 1.00 10.00 C ATOM 950 OE1 GLU A 62 7.935 -15.163 0.117 1.00 10.00 O ATOM 951 OE2 GLU A 62 9.691 -14.011 -0.614 1.00 10.00 O ATOM 0 H GLU A 62 5.136 -12.706 -0.209 1.00 10.00 H new ATOM 0 HA GLU A 62 5.806 -11.394 -2.464 1.00 10.00 H new ATOM 0 HB2 GLU A 62 6.355 -14.346 -1.841 1.00 10.00 H new ATOM 0 HB3 GLU A 62 7.368 -13.303 -2.818 1.00 10.00 H new ATOM 0 HG2 GLU A 62 8.130 -12.068 -0.894 1.00 10.00 H new ATOM 0 HG3 GLU A 62 6.888 -12.752 0.135 1.00 10.00 H new ATOM 958 N THR A 63 4.189 -14.170 -3.292 1.00 10.00 N ATOM 959 CA THR A 63 3.559 -14.958 -4.349 1.00 10.00 C ATOM 960 C THR A 63 2.310 -14.304 -4.921 1.00 10.00 C ATOM 961 O THR A 63 2.044 -14.480 -6.105 1.00 10.00 O ATOM 962 CB THR A 63 3.278 -16.383 -3.841 1.00 10.00 C ATOM 963 OG1 THR A 63 2.465 -16.382 -2.684 1.00 10.00 O ATOM 964 CG2 THR A 63 4.574 -17.098 -3.451 1.00 10.00 C ATOM 0 H THR A 63 4.156 -14.633 -2.384 1.00 10.00 H new ATOM 0 HA THR A 63 4.262 -15.011 -5.181 1.00 10.00 H new ATOM 0 HB THR A 63 2.775 -16.892 -4.663 1.00 10.00 H new ATOM 0 HG1 THR A 63 2.174 -17.297 -2.488 1.00 10.00 H new ATOM 0 HG21 THR A 63 4.343 -18.102 -3.096 1.00 10.00 H new ATOM 0 HG22 THR A 63 5.230 -17.162 -4.319 1.00 10.00 H new ATOM 0 HG23 THR A 63 5.074 -16.540 -2.659 1.00 10.00 H new ATOM 972 N LEU A 64 1.585 -13.489 -4.144 1.00 10.00 N ATOM 973 CA LEU A 64 0.450 -12.697 -4.612 1.00 10.00 C ATOM 974 C LEU A 64 0.888 -11.479 -5.429 1.00 10.00 C ATOM 975 O LEU A 64 0.149 -11.046 -6.319 1.00 10.00 O ATOM 976 CB LEU A 64 -0.433 -12.303 -3.410 1.00 10.00 C ATOM 977 CG LEU A 64 -1.910 -12.730 -3.534 1.00 10.00 C ATOM 978 CD1 LEU A 64 -2.527 -12.758 -2.142 1.00 10.00 C ATOM 979 CD2 LEU A 64 -2.749 -11.750 -4.354 1.00 10.00 C ATOM 0 H LEU A 64 1.779 -13.362 -3.151 1.00 10.00 H new ATOM 0 HA LEU A 64 -0.141 -13.310 -5.293 1.00 10.00 H new ATOM 0 HB2 LEU A 64 -0.014 -12.747 -2.507 1.00 10.00 H new ATOM 0 HB3 LEU A 64 -0.390 -11.221 -3.283 1.00 10.00 H new ATOM 0 HG LEU A 64 -1.914 -13.701 -4.029 1.00 10.00 H new ATOM 0 HD11 LEU A 64 -3.572 -13.058 -2.213 1.00 10.00 H new ATOM 0 HD12 LEU A 64 -1.986 -13.470 -1.519 1.00 10.00 H new ATOM 0 HD13 LEU A 64 -2.464 -11.765 -1.696 1.00 10.00 H new ATOM 0 HD21 LEU A 64 -3.778 -12.106 -4.405 1.00 10.00 H new ATOM 0 HD22 LEU A 64 -2.727 -10.768 -3.881 1.00 10.00 H new ATOM 0 HD23 LEU A 64 -2.341 -11.676 -5.362 1.00 10.00 H new ATOM 991 N MET A 65 2.084 -10.940 -5.160 1.00 10.00 N ATOM 992 CA MET A 65 2.672 -9.886 -5.982 1.00 10.00 C ATOM 993 C MET A 65 3.086 -10.430 -7.345 1.00 10.00 C ATOM 994 O MET A 65 2.685 -9.859 -8.355 1.00 10.00 O ATOM 995 CB MET A 65 3.817 -9.158 -5.258 1.00 10.00 C ATOM 996 CG MET A 65 3.290 -8.454 -4.001 1.00 10.00 C ATOM 997 SD MET A 65 4.450 -7.353 -3.152 1.00 10.00 S ATOM 998 CE MET A 65 5.527 -8.575 -2.361 1.00 10.00 C ATOM 0 H MET A 65 2.665 -11.223 -4.371 1.00 10.00 H new ATOM 0 HA MET A 65 1.906 -9.130 -6.157 1.00 10.00 H new ATOM 0 HB2 MET A 65 4.595 -9.871 -4.985 1.00 10.00 H new ATOM 0 HB3 MET A 65 4.274 -8.429 -5.927 1.00 10.00 H new ATOM 0 HG2 MET A 65 2.409 -7.875 -4.277 1.00 10.00 H new ATOM 0 HG3 MET A 65 2.962 -9.216 -3.294 1.00 10.00 H new ATOM 0 HE1 MET A 65 6.270 -8.063 -1.750 1.00 10.00 H new ATOM 0 HE2 MET A 65 4.929 -9.233 -1.730 1.00 10.00 H new ATOM 0 HE3 MET A 65 6.031 -9.166 -3.126 1.00 10.00 H new ATOM 1008 N GLU A 66 3.784 -11.573 -7.378 1.00 10.00 N ATOM 1009 CA GLU A 66 4.146 -12.226 -8.647 1.00 10.00 C ATOM 1010 C GLU A 66 2.887 -12.629 -9.419 1.00 10.00 C ATOM 1011 O GLU A 66 2.778 -12.400 -10.623 1.00 10.00 O ATOM 1012 CB GLU A 66 5.009 -13.469 -8.373 1.00 10.00 C ATOM 1013 CG GLU A 66 5.686 -14.032 -9.636 1.00 10.00 C ATOM 1014 CD GLU A 66 6.620 -13.044 -10.350 1.00 10.00 C ATOM 1015 OE1 GLU A 66 7.405 -12.377 -9.641 1.00 10.00 O ATOM 1016 OE2 GLU A 66 6.548 -12.979 -11.600 1.00 10.00 O ATOM 0 H GLU A 66 4.109 -12.064 -6.545 1.00 10.00 H new ATOM 0 HA GLU A 66 4.717 -11.519 -9.250 1.00 10.00 H new ATOM 0 HB2 GLU A 66 5.776 -13.216 -7.641 1.00 10.00 H new ATOM 0 HB3 GLU A 66 4.386 -14.244 -7.927 1.00 10.00 H new ATOM 0 HG2 GLU A 66 6.257 -14.919 -9.362 1.00 10.00 H new ATOM 0 HG3 GLU A 66 4.914 -14.353 -10.335 1.00 10.00 H new ATOM 1023 N TYR A 67 1.913 -13.185 -8.692 1.00 10.00 N ATOM 1024 CA TYR A 67 0.617 -13.566 -9.223 1.00 10.00 C ATOM 1025 C TYR A 67 -0.114 -12.379 -9.851 1.00 10.00 C ATOM 1026 O TYR A 67 -0.288 -12.398 -11.059 1.00 10.00 O ATOM 1027 CB TYR A 67 -0.191 -14.202 -8.103 1.00 10.00 C ATOM 1028 CG TYR A 67 -1.670 -14.403 -8.339 1.00 10.00 C ATOM 1029 CD1 TYR A 67 -2.095 -15.351 -9.276 1.00 10.00 C ATOM 1030 CD2 TYR A 67 -2.617 -13.730 -7.545 1.00 10.00 C ATOM 1031 CE1 TYR A 67 -3.461 -15.654 -9.398 1.00 10.00 C ATOM 1032 CE2 TYR A 67 -3.987 -14.032 -7.654 1.00 10.00 C ATOM 1033 CZ TYR A 67 -4.412 -15.020 -8.568 1.00 10.00 C ATOM 1034 OH TYR A 67 -5.726 -15.367 -8.650 1.00 10.00 O ATOM 0 H TYR A 67 2.014 -13.384 -7.697 1.00 10.00 H new ATOM 0 HA TYR A 67 0.753 -14.288 -10.028 1.00 10.00 H new ATOM 0 HB2 TYR A 67 0.249 -15.174 -7.880 1.00 10.00 H new ATOM 0 HB3 TYR A 67 -0.073 -13.586 -7.211 1.00 10.00 H new ATOM 0 HD1 TYR A 67 -1.373 -15.850 -9.905 1.00 10.00 H new ATOM 0 HD2 TYR A 67 -2.289 -12.975 -6.846 1.00 10.00 H new ATOM 0 HE1 TYR A 67 -3.787 -16.377 -10.132 1.00 10.00 H new ATOM 0 HE2 TYR A 67 -4.709 -13.511 -7.042 1.00 10.00 H new ATOM 0 HH TYR A 67 -6.282 -14.563 -8.579 1.00 10.00 H new ATOM 1044 N LEU A 68 -0.557 -11.354 -9.104 1.00 10.00 N ATOM 1045 CA LEU A 68 -1.380 -10.300 -9.730 1.00 10.00 C ATOM 1046 C LEU A 68 -0.652 -9.454 -10.779 1.00 10.00 C ATOM 1047 O LEU A 68 -1.326 -8.833 -11.597 1.00 10.00 O ATOM 1048 CB LEU A 68 -2.027 -9.359 -8.704 1.00 10.00 C ATOM 1049 CG LEU A 68 -3.331 -9.830 -8.037 1.00 10.00 C ATOM 1050 CD1 LEU A 68 -4.075 -8.603 -7.507 1.00 10.00 C ATOM 1051 CD2 LEU A 68 -4.299 -10.555 -8.973 1.00 10.00 C ATOM 0 H LEU A 68 -0.371 -11.231 -8.109 1.00 10.00 H new ATOM 0 HA LEU A 68 -2.153 -10.871 -10.245 1.00 10.00 H new ATOM 0 HB2 LEU A 68 -1.297 -9.165 -7.918 1.00 10.00 H new ATOM 0 HB3 LEU A 68 -2.225 -8.407 -9.197 1.00 10.00 H new ATOM 0 HG LEU A 68 -3.029 -10.534 -7.261 1.00 10.00 H new ATOM 0 HD11 LEU A 68 -5.003 -8.918 -7.030 1.00 10.00 H new ATOM 0 HD12 LEU A 68 -3.451 -8.085 -6.779 1.00 10.00 H new ATOM 0 HD13 LEU A 68 -4.302 -7.930 -8.334 1.00 10.00 H new ATOM 0 HD21 LEU A 68 -5.189 -10.850 -8.418 1.00 10.00 H new ATOM 0 HD22 LEU A 68 -4.584 -9.890 -9.788 1.00 10.00 H new ATOM 0 HD23 LEU A 68 -3.815 -11.442 -9.381 1.00 10.00 H new ATOM 1063 N GLU A 69 0.682 -9.418 -10.793 1.00 10.00 N ATOM 1064 CA GLU A 69 1.401 -8.831 -11.917 1.00 10.00 C ATOM 1065 C GLU A 69 1.392 -9.703 -13.187 1.00 10.00 C ATOM 1066 O GLU A 69 1.506 -9.152 -14.284 1.00 10.00 O ATOM 1067 CB GLU A 69 2.836 -8.560 -11.451 1.00 10.00 C ATOM 1068 CG GLU A 69 2.971 -7.357 -10.492 1.00 10.00 C ATOM 1069 CD GLU A 69 2.537 -5.996 -11.067 1.00 10.00 C ATOM 1070 OE1 GLU A 69 2.578 -5.837 -12.306 1.00 10.00 O ATOM 1071 OE2 GLU A 69 2.176 -5.116 -10.249 1.00 10.00 O ATOM 0 H GLU A 69 1.276 -9.784 -10.049 1.00 10.00 H new ATOM 0 HA GLU A 69 0.893 -7.911 -12.208 1.00 10.00 H new ATOM 0 HB2 GLU A 69 3.220 -9.451 -10.955 1.00 10.00 H new ATOM 0 HB3 GLU A 69 3.464 -8.386 -12.325 1.00 10.00 H new ATOM 0 HG2 GLU A 69 2.380 -7.559 -9.599 1.00 10.00 H new ATOM 0 HG3 GLU A 69 4.011 -7.282 -10.175 1.00 10.00 H new ATOM 1078 N ASN A 70 1.224 -11.031 -13.091 1.00 10.00 N ATOM 1079 CA ASN A 70 1.257 -11.946 -14.248 1.00 10.00 C ATOM 1080 C ASN A 70 0.625 -13.338 -13.942 1.00 10.00 C ATOM 1081 O ASN A 70 1.301 -14.370 -13.995 1.00 10.00 O ATOM 1082 CB ASN A 70 2.733 -12.015 -14.747 1.00 10.00 C ATOM 1083 CG ASN A 70 2.923 -11.539 -16.180 1.00 10.00 C ATOM 1084 OD1 ASN A 70 3.548 -12.207 -16.992 1.00 10.00 O ATOM 1085 ND2 ASN A 70 2.462 -10.355 -16.518 1.00 10.00 N ATOM 0 H ASN A 70 1.060 -11.506 -12.203 1.00 10.00 H new ATOM 0 HA ASN A 70 0.627 -11.561 -15.050 1.00 10.00 H new ATOM 0 HB2 ASN A 70 3.357 -11.411 -14.088 1.00 10.00 H new ATOM 0 HB3 ASN A 70 3.086 -13.043 -14.666 1.00 10.00 H new ATOM 0 HD21 ASN A 70 2.625 -9.993 -17.458 1.00 10.00 H new ATOM 0 HD22 ASN A 70 1.941 -9.798 -15.841 1.00 10.00 H new ATOM 1092 N PRO A 71 -0.693 -13.428 -13.657 1.00 10.00 N ATOM 1093 CA PRO A 71 -1.260 -14.573 -12.939 1.00 10.00 C ATOM 1094 C PRO A 71 -1.312 -15.841 -13.785 1.00 10.00 C ATOM 1095 O PRO A 71 -0.867 -16.893 -13.332 1.00 10.00 O ATOM 1096 CB PRO A 71 -2.643 -14.133 -12.450 1.00 10.00 C ATOM 1097 CG PRO A 71 -3.018 -12.968 -13.356 1.00 10.00 C ATOM 1098 CD PRO A 71 -1.676 -12.362 -13.773 1.00 10.00 C ATOM 0 HA PRO A 71 -0.622 -14.848 -12.099 1.00 10.00 H new ATOM 0 HB2 PRO A 71 -3.367 -14.944 -12.527 1.00 10.00 H new ATOM 0 HB3 PRO A 71 -2.615 -13.829 -11.404 1.00 10.00 H new ATOM 0 HG2 PRO A 71 -3.588 -13.306 -14.222 1.00 10.00 H new ATOM 0 HG3 PRO A 71 -3.637 -12.240 -12.831 1.00 10.00 H new ATOM 0 HD2 PRO A 71 -1.721 -11.984 -14.794 1.00 10.00 H new ATOM 0 HD3 PRO A 71 -1.414 -11.520 -13.132 1.00 10.00 H new ATOM 1106 N LYS A 72 -1.790 -15.735 -15.033 1.00 10.00 N ATOM 1107 CA LYS A 72 -1.833 -16.829 -15.999 1.00 10.00 C ATOM 1108 C LYS A 72 -0.437 -17.364 -16.351 1.00 10.00 C ATOM 1109 O LYS A 72 -0.313 -18.524 -16.725 1.00 10.00 O ATOM 1110 CB LYS A 72 -2.560 -16.384 -17.279 1.00 10.00 C ATOM 1111 CG LYS A 72 -4.056 -16.065 -17.108 1.00 10.00 C ATOM 1112 CD LYS A 72 -4.335 -14.571 -16.880 1.00 10.00 C ATOM 1113 CE LYS A 72 -5.651 -14.346 -16.126 1.00 10.00 C ATOM 1114 NZ LYS A 72 -6.825 -14.270 -17.023 1.00 10.00 N ATOM 0 H LYS A 72 -2.166 -14.862 -15.403 1.00 10.00 H new ATOM 0 HA LYS A 72 -2.382 -17.644 -15.527 1.00 10.00 H new ATOM 0 HB2 LYS A 72 -2.059 -15.499 -17.673 1.00 10.00 H new ATOM 0 HB3 LYS A 72 -2.456 -17.169 -18.028 1.00 10.00 H new ATOM 0 HG2 LYS A 72 -4.595 -16.397 -17.995 1.00 10.00 H new ATOM 0 HG3 LYS A 72 -4.448 -16.634 -16.265 1.00 10.00 H new ATOM 0 HD2 LYS A 72 -3.513 -14.130 -16.316 1.00 10.00 H new ATOM 0 HD3 LYS A 72 -4.374 -14.058 -17.841 1.00 10.00 H new ATOM 0 HE2 LYS A 72 -5.798 -15.157 -15.412 1.00 10.00 H new ATOM 0 HE3 LYS A 72 -5.580 -13.423 -15.550 1.00 10.00 H new ATOM 0 HZ1 LYS A 72 -7.662 -13.984 -16.476 1.00 10.00 H new ATOM 0 HZ2 LYS A 72 -6.645 -13.571 -17.772 1.00 10.00 H new ATOM 0 HZ3 LYS A 72 -6.995 -15.202 -17.453 1.00 10.00 H new ATOM 1128 N LYS A 73 0.612 -16.535 -16.235 1.00 10.00 N ATOM 1129 CA LYS A 73 2.009 -16.971 -16.331 1.00 10.00 C ATOM 1130 C LYS A 73 2.459 -17.679 -15.052 1.00 10.00 C ATOM 1131 O LYS A 73 3.065 -18.742 -15.130 1.00 10.00 O ATOM 1132 CB LYS A 73 2.918 -15.778 -16.659 1.00 10.00 C ATOM 1133 CG LYS A 73 4.291 -16.247 -17.173 1.00 10.00 C ATOM 1134 CD LYS A 73 5.207 -15.067 -17.520 1.00 10.00 C ATOM 1135 CE LYS A 73 5.744 -14.386 -16.252 1.00 10.00 C ATOM 1136 NZ LYS A 73 6.124 -12.982 -16.517 1.00 10.00 N ATOM 0 H LYS A 73 0.510 -15.534 -16.070 1.00 10.00 H new ATOM 0 HA LYS A 73 2.087 -17.693 -17.144 1.00 10.00 H new ATOM 0 HB2 LYS A 73 2.441 -15.150 -17.411 1.00 10.00 H new ATOM 0 HB3 LYS A 73 3.051 -15.163 -15.769 1.00 10.00 H new ATOM 0 HG2 LYS A 73 4.770 -16.867 -16.415 1.00 10.00 H new ATOM 0 HG3 LYS A 73 4.154 -16.872 -18.056 1.00 10.00 H new ATOM 0 HD2 LYS A 73 6.041 -15.418 -18.128 1.00 10.00 H new ATOM 0 HD3 LYS A 73 4.658 -14.342 -18.120 1.00 10.00 H new ATOM 0 HE2 LYS A 73 4.985 -14.418 -15.470 1.00 10.00 H new ATOM 0 HE3 LYS A 73 6.609 -14.935 -15.880 1.00 10.00 H new ATOM 0 HZ1 LYS A 73 6.709 -12.627 -15.734 1.00 10.00 H new ATOM 0 HZ2 LYS A 73 6.665 -12.930 -17.404 1.00 10.00 H new ATOM 0 HZ3 LYS A 73 5.266 -12.400 -16.600 1.00 10.00 H new ATOM 1150 N TYR A 74 2.183 -17.078 -13.888 1.00 10.00 N ATOM 1151 CA TYR A 74 2.627 -17.590 -12.594 1.00 10.00 C ATOM 1152 C TYR A 74 1.994 -18.938 -12.217 1.00 10.00 C ATOM 1153 O TYR A 74 2.678 -19.795 -11.661 1.00 10.00 O ATOM 1154 CB TYR A 74 2.387 -16.525 -11.517 1.00 10.00 C ATOM 1155 CG TYR A 74 3.035 -16.865 -10.189 1.00 10.00 C ATOM 1156 CD1 TYR A 74 4.421 -17.114 -10.127 1.00 10.00 C ATOM 1157 CD2 TYR A 74 2.258 -16.938 -9.019 1.00 10.00 C ATOM 1158 CE1 TYR A 74 5.028 -17.453 -8.906 1.00 10.00 C ATOM 1159 CE2 TYR A 74 2.866 -17.238 -7.788 1.00 10.00 C ATOM 1160 CZ TYR A 74 4.248 -17.516 -7.734 1.00 10.00 C ATOM 1161 OH TYR A 74 4.829 -17.852 -6.554 1.00 10.00 O ATOM 0 H TYR A 74 1.641 -16.216 -13.822 1.00 10.00 H new ATOM 0 HA TYR A 74 3.695 -17.795 -12.670 1.00 10.00 H new ATOM 0 HB2 TYR A 74 2.773 -15.568 -11.868 1.00 10.00 H new ATOM 0 HB3 TYR A 74 1.314 -16.401 -11.370 1.00 10.00 H new ATOM 0 HD1 TYR A 74 5.020 -17.044 -11.023 1.00 10.00 H new ATOM 0 HD2 TYR A 74 1.193 -16.763 -9.067 1.00 10.00 H new ATOM 0 HE1 TYR A 74 6.086 -17.664 -8.866 1.00 10.00 H new ATOM 0 HE2 TYR A 74 2.276 -17.256 -6.884 1.00 10.00 H new ATOM 0 HH TYR A 74 5.765 -17.561 -6.555 1.00 10.00 H new ATOM 1171 N ILE A 75 0.709 -19.138 -12.536 1.00 10.00 N ATOM 1172 CA ILE A 75 -0.036 -20.376 -12.277 1.00 10.00 C ATOM 1173 C ILE A 75 -1.002 -20.656 -13.450 1.00 10.00 C ATOM 1174 O ILE A 75 -2.008 -19.959 -13.604 1.00 10.00 O ATOM 1175 CB ILE A 75 -0.739 -20.367 -10.891 1.00 10.00 C ATOM 1176 CG1 ILE A 75 -1.091 -18.944 -10.393 1.00 10.00 C ATOM 1177 CG2 ILE A 75 0.163 -21.103 -9.880 1.00 10.00 C ATOM 1178 CD1 ILE A 75 -1.896 -18.916 -9.095 1.00 10.00 C ATOM 0 H ILE A 75 0.144 -18.423 -12.994 1.00 10.00 H new ATOM 0 HA ILE A 75 0.671 -21.204 -12.223 1.00 10.00 H new ATOM 0 HB ILE A 75 -1.695 -20.881 -10.992 1.00 10.00 H new ATOM 0 HG12 ILE A 75 -0.168 -18.384 -10.247 1.00 10.00 H new ATOM 0 HG13 ILE A 75 -1.657 -18.429 -11.169 1.00 10.00 H new ATOM 0 HG21 ILE A 75 -0.315 -21.106 -8.901 1.00 10.00 H new ATOM 0 HG22 ILE A 75 0.319 -22.130 -10.211 1.00 10.00 H new ATOM 0 HG23 ILE A 75 1.124 -20.594 -9.812 1.00 10.00 H new ATOM 0 HD11 ILE A 75 -2.100 -17.882 -8.816 1.00 10.00 H new ATOM 0 HD12 ILE A 75 -2.838 -19.446 -9.239 1.00 10.00 H new ATOM 0 HD13 ILE A 75 -1.325 -19.400 -8.302 1.00 10.00 H new ATOM 1190 N PRO A 76 -0.689 -21.640 -14.322 1.00 10.00 N ATOM 1191 CA PRO A 76 -1.176 -21.681 -15.704 1.00 10.00 C ATOM 1192 C PRO A 76 -2.683 -21.902 -15.861 1.00 10.00 C ATOM 1193 O PRO A 76 -3.252 -21.483 -16.867 1.00 10.00 O ATOM 1194 CB PRO A 76 -0.364 -22.781 -16.398 1.00 10.00 C ATOM 1195 CG PRO A 76 0.066 -23.692 -15.252 1.00 10.00 C ATOM 1196 CD PRO A 76 0.284 -22.702 -14.111 1.00 10.00 C ATOM 0 HA PRO A 76 -1.032 -20.701 -16.160 1.00 10.00 H new ATOM 0 HB2 PRO A 76 -0.964 -23.318 -17.133 1.00 10.00 H new ATOM 0 HB3 PRO A 76 0.496 -22.370 -16.927 1.00 10.00 H new ATOM 0 HG2 PRO A 76 -0.700 -24.429 -15.010 1.00 10.00 H new ATOM 0 HG3 PRO A 76 0.975 -24.244 -15.491 1.00 10.00 H new ATOM 0 HD2 PRO A 76 0.137 -23.181 -13.143 1.00 10.00 H new ATOM 0 HD3 PRO A 76 1.301 -22.310 -14.122 1.00 10.00 H new ATOM 1204 N GLY A 77 -3.350 -22.517 -14.878 1.00 10.00 N ATOM 1205 CA GLY A 77 -4.790 -22.740 -14.920 1.00 10.00 C ATOM 1206 C GLY A 77 -5.627 -21.554 -14.438 1.00 10.00 C ATOM 1207 O GLY A 77 -6.847 -21.597 -14.584 1.00 10.00 O ATOM 0 H GLY A 77 -2.902 -22.872 -14.033 1.00 10.00 H new ATOM 0 HA2 GLY A 77 -5.078 -22.981 -15.943 1.00 10.00 H new ATOM 0 HA3 GLY A 77 -5.029 -23.610 -14.308 1.00 10.00 H new ATOM 1211 N THR A 78 -5.028 -20.508 -13.847 1.00 10.00 N ATOM 1212 CA THR A 78 -5.789 -19.417 -13.218 1.00 10.00 C ATOM 1213 C THR A 78 -6.376 -18.448 -14.244 1.00 10.00 C ATOM 1214 O THR A 78 -5.937 -17.306 -14.395 1.00 10.00 O ATOM 1215 CB THR A 78 -4.969 -18.701 -12.137 1.00 10.00 C ATOM 1216 OG1 THR A 78 -4.597 -19.659 -11.183 1.00 10.00 O ATOM 1217 CG2 THR A 78 -5.804 -17.640 -11.409 1.00 10.00 C ATOM 0 H THR A 78 -4.016 -20.395 -13.792 1.00 10.00 H new ATOM 0 HA THR A 78 -6.641 -19.875 -12.715 1.00 10.00 H new ATOM 0 HB THR A 78 -4.114 -18.219 -12.610 1.00 10.00 H new ATOM 0 HG1 THR A 78 -3.632 -19.821 -11.241 1.00 10.00 H new ATOM 0 HG21 THR A 78 -5.192 -17.153 -10.650 1.00 10.00 H new ATOM 0 HG22 THR A 78 -6.153 -16.897 -12.126 1.00 10.00 H new ATOM 0 HG23 THR A 78 -6.661 -18.116 -10.933 1.00 10.00 H new ATOM 1225 N LYS A 79 -7.451 -18.883 -14.909 1.00 10.00 N ATOM 1226 CA LYS A 79 -8.238 -18.130 -15.895 1.00 10.00 C ATOM 1227 C LYS A 79 -9.054 -16.954 -15.306 1.00 10.00 C ATOM 1228 O LYS A 79 -10.077 -16.556 -15.858 1.00 10.00 O ATOM 1229 CB LYS A 79 -9.106 -19.123 -16.700 1.00 10.00 C ATOM 1230 CG LYS A 79 -9.174 -18.652 -18.157 1.00 10.00 C ATOM 1231 CD LYS A 79 -10.104 -19.484 -19.047 1.00 10.00 C ATOM 1232 CE LYS A 79 -9.881 -19.158 -20.533 1.00 10.00 C ATOM 1233 NZ LYS A 79 -9.986 -17.707 -20.826 1.00 10.00 N ATOM 0 H LYS A 79 -7.818 -19.824 -14.766 1.00 10.00 H new ATOM 0 HA LYS A 79 -7.539 -17.630 -16.566 1.00 10.00 H new ATOM 0 HB2 LYS A 79 -8.680 -20.125 -16.647 1.00 10.00 H new ATOM 0 HB3 LYS A 79 -10.108 -19.179 -16.274 1.00 10.00 H new ATOM 0 HG2 LYS A 79 -9.506 -17.614 -18.176 1.00 10.00 H new ATOM 0 HG3 LYS A 79 -8.170 -18.674 -18.581 1.00 10.00 H new ATOM 0 HD2 LYS A 79 -9.926 -20.545 -18.873 1.00 10.00 H new ATOM 0 HD3 LYS A 79 -11.142 -19.287 -18.779 1.00 10.00 H new ATOM 0 HE2 LYS A 79 -8.896 -19.514 -20.835 1.00 10.00 H new ATOM 0 HE3 LYS A 79 -10.613 -19.699 -21.133 1.00 10.00 H new ATOM 0 HZ1 LYS A 79 -9.946 -17.557 -21.854 1.00 10.00 H new ATOM 0 HZ2 LYS A 79 -10.888 -17.343 -20.458 1.00 10.00 H new ATOM 0 HZ3 LYS A 79 -9.198 -17.203 -20.371 1.00 10.00 H new ATOM 1247 N MET A 80 -8.595 -16.379 -14.188 1.00 10.00 N ATOM 1248 CA MET A 80 -9.180 -15.246 -13.468 1.00 10.00 C ATOM 1249 C MET A 80 -9.470 -14.061 -14.405 1.00 10.00 C ATOM 1250 O MET A 80 -8.556 -13.487 -15.012 1.00 10.00 O ATOM 1251 CB MET A 80 -8.254 -14.871 -12.299 1.00 10.00 C ATOM 1252 CG MET A 80 -8.619 -13.527 -11.652 1.00 10.00 C ATOM 1253 SD MET A 80 -7.765 -13.169 -10.095 1.00 10.00 S ATOM 1254 CE MET A 80 -6.084 -12.947 -10.709 1.00 10.00 C ATOM 0 H MET A 80 -7.747 -16.718 -13.733 1.00 10.00 H new ATOM 0 HA MET A 80 -10.150 -15.533 -13.062 1.00 10.00 H new ATOM 0 HB2 MET A 80 -8.296 -15.655 -11.543 1.00 10.00 H new ATOM 0 HB3 MET A 80 -7.225 -14.828 -12.657 1.00 10.00 H new ATOM 0 HG2 MET A 80 -8.400 -12.728 -12.361 1.00 10.00 H new ATOM 0 HG3 MET A 80 -9.694 -13.508 -11.472 1.00 10.00 H new ATOM 0 HE1 MET A 80 -5.411 -12.771 -9.870 1.00 10.00 H new ATOM 0 HE2 MET A 80 -5.771 -13.844 -11.244 1.00 10.00 H new ATOM 0 HE3 MET A 80 -6.053 -12.092 -11.385 1.00 10.00 H new ATOM 1264 N ILE A 81 -10.753 -13.699 -14.518 1.00 10.00 N ATOM 1265 CA ILE A 81 -11.261 -12.609 -15.362 1.00 10.00 C ATOM 1266 C ILE A 81 -10.963 -11.253 -14.692 1.00 10.00 C ATOM 1267 O ILE A 81 -11.858 -10.545 -14.233 1.00 10.00 O ATOM 1268 CB ILE A 81 -12.761 -12.815 -15.714 1.00 10.00 C ATOM 1269 CG1 ILE A 81 -13.052 -14.262 -16.194 1.00 10.00 C ATOM 1270 CG2 ILE A 81 -13.171 -11.813 -16.814 1.00 10.00 C ATOM 1271 CD1 ILE A 81 -14.531 -14.551 -16.484 1.00 10.00 C ATOM 0 H ILE A 81 -11.495 -14.175 -14.005 1.00 10.00 H new ATOM 0 HA ILE A 81 -10.740 -12.615 -16.319 1.00 10.00 H new ATOM 0 HB ILE A 81 -13.343 -12.644 -14.809 1.00 10.00 H new ATOM 0 HG12 ILE A 81 -12.473 -14.455 -17.097 1.00 10.00 H new ATOM 0 HG13 ILE A 81 -12.700 -14.961 -15.435 1.00 10.00 H new ATOM 0 HG21 ILE A 81 -14.223 -11.956 -17.062 1.00 10.00 H new ATOM 0 HG22 ILE A 81 -13.018 -10.795 -16.455 1.00 10.00 H new ATOM 0 HG23 ILE A 81 -12.562 -11.979 -17.703 1.00 10.00 H new ATOM 0 HD11 ILE A 81 -14.642 -15.584 -16.814 1.00 10.00 H new ATOM 0 HD12 ILE A 81 -15.117 -14.394 -15.578 1.00 10.00 H new ATOM 0 HD13 ILE A 81 -14.886 -13.880 -17.267 1.00 10.00 H new ATOM 1283 N PHE A 82 -9.672 -10.909 -14.632 1.00 10.00 N ATOM 1284 CA PHE A 82 -9.155 -9.620 -14.155 1.00 10.00 C ATOM 1285 C PHE A 82 -7.690 -9.356 -14.560 1.00 10.00 C ATOM 1286 O PHE A 82 -7.329 -8.212 -14.812 1.00 10.00 O ATOM 1287 CB PHE A 82 -9.277 -9.531 -12.623 1.00 10.00 C ATOM 1288 CG PHE A 82 -9.107 -8.126 -12.090 1.00 10.00 C ATOM 1289 CD1 PHE A 82 -9.959 -7.085 -12.511 1.00 10.00 C ATOM 1290 CD2 PHE A 82 -8.063 -7.855 -11.197 1.00 10.00 C ATOM 1291 CE1 PHE A 82 -9.728 -5.768 -12.077 1.00 10.00 C ATOM 1292 CE2 PHE A 82 -7.817 -6.536 -10.779 1.00 10.00 C ATOM 1293 CZ PHE A 82 -8.645 -5.490 -11.223 1.00 10.00 C ATOM 0 H PHE A 82 -8.930 -11.544 -14.925 1.00 10.00 H new ATOM 0 HA PHE A 82 -9.766 -8.856 -14.635 1.00 10.00 H new ATOM 0 HB2 PHE A 82 -10.253 -9.911 -12.320 1.00 10.00 H new ATOM 0 HB3 PHE A 82 -8.527 -10.178 -12.168 1.00 10.00 H new ATOM 0 HD1 PHE A 82 -10.790 -7.299 -13.167 1.00 10.00 H new ATOM 0 HD2 PHE A 82 -7.446 -8.661 -10.829 1.00 10.00 H new ATOM 0 HE1 PHE A 82 -10.381 -4.970 -12.399 1.00 10.00 H new ATOM 0 HE2 PHE A 82 -6.991 -6.326 -10.116 1.00 10.00 H new ATOM 0 HZ PHE A 82 -8.450 -4.475 -10.909 1.00 10.00 H new ATOM 1303 N ALA A 83 -6.865 -10.410 -14.661 1.00 10.00 N ATOM 1304 CA ALA A 83 -5.410 -10.451 -14.897 1.00 10.00 C ATOM 1305 C ALA A 83 -4.468 -9.527 -14.095 1.00 10.00 C ATOM 1306 O ALA A 83 -3.309 -9.900 -13.961 1.00 10.00 O ATOM 1307 CB ALA A 83 -5.109 -10.282 -16.388 1.00 10.00 C ATOM 0 H ALA A 83 -7.239 -11.355 -14.570 1.00 10.00 H new ATOM 0 HA ALA A 83 -5.169 -11.438 -14.502 1.00 10.00 H new ATOM 0 HB1 ALA A 83 -4.031 -10.314 -16.548 1.00 10.00 H new ATOM 0 HB2 ALA A 83 -5.583 -11.088 -16.948 1.00 10.00 H new ATOM 0 HB3 ALA A 83 -5.498 -9.323 -16.731 1.00 10.00 H new ATOM 1313 N GLY A 84 -4.890 -8.386 -13.548 1.00 10.00 N ATOM 1314 CA GLY A 84 -4.007 -7.552 -12.733 1.00 10.00 C ATOM 1315 C GLY A 84 -4.616 -6.214 -12.338 1.00 10.00 C ATOM 1316 O GLY A 84 -5.648 -5.799 -12.858 1.00 10.00 O ATOM 0 H GLY A 84 -5.836 -8.019 -13.654 1.00 10.00 H new ATOM 0 HA2 GLY A 84 -3.738 -8.099 -11.829 1.00 10.00 H new ATOM 0 HA3 GLY A 84 -3.083 -7.372 -13.283 1.00 10.00 H new ATOM 1320 N ILE A 85 -3.962 -5.545 -11.387 1.00 10.00 N ATOM 1321 CA ILE A 85 -4.455 -4.312 -10.771 1.00 10.00 C ATOM 1322 C ILE A 85 -3.912 -3.058 -11.481 1.00 10.00 C ATOM 1323 O ILE A 85 -2.913 -3.101 -12.194 1.00 10.00 O ATOM 1324 CB ILE A 85 -4.167 -4.363 -9.254 1.00 10.00 C ATOM 1325 CG1 ILE A 85 -5.080 -3.390 -8.480 1.00 10.00 C ATOM 1326 CG2 ILE A 85 -2.681 -4.132 -8.930 1.00 10.00 C ATOM 1327 CD1 ILE A 85 -5.190 -3.758 -7.000 1.00 10.00 C ATOM 0 H ILE A 85 -3.061 -5.849 -11.018 1.00 10.00 H new ATOM 0 HA ILE A 85 -5.535 -4.237 -10.894 1.00 10.00 H new ATOM 0 HB ILE A 85 -4.400 -5.374 -8.919 1.00 10.00 H new ATOM 0 HG12 ILE A 85 -4.690 -2.376 -8.573 1.00 10.00 H new ATOM 0 HG13 ILE A 85 -6.074 -3.392 -8.928 1.00 10.00 H new ATOM 0 HG21 ILE A 85 -2.532 -4.178 -7.851 1.00 10.00 H new ATOM 0 HG22 ILE A 85 -2.079 -4.903 -9.412 1.00 10.00 H new ATOM 0 HG23 ILE A 85 -2.377 -3.152 -9.297 1.00 10.00 H new ATOM 0 HD11 ILE A 85 -5.843 -3.045 -6.495 1.00 10.00 H new ATOM 0 HD12 ILE A 85 -5.605 -4.761 -6.904 1.00 10.00 H new ATOM 0 HD13 ILE A 85 -4.201 -3.730 -6.544 1.00 10.00 H new ATOM 1339 N LYS A 86 -4.587 -1.920 -11.275 1.00 10.00 N ATOM 1340 CA LYS A 86 -4.427 -0.669 -12.032 1.00 10.00 C ATOM 1341 C LYS A 86 -3.014 -0.073 -12.056 1.00 10.00 C ATOM 1342 O LYS A 86 -2.665 0.589 -13.029 1.00 10.00 O ATOM 1343 CB LYS A 86 -5.405 0.369 -11.461 1.00 10.00 C ATOM 1344 CG LYS A 86 -6.876 0.077 -11.790 1.00 10.00 C ATOM 1345 CD LYS A 86 -7.216 0.427 -13.246 1.00 10.00 C ATOM 1346 CE LYS A 86 -8.735 0.472 -13.404 1.00 10.00 C ATOM 1347 NZ LYS A 86 -9.138 0.985 -14.730 1.00 10.00 N ATOM 0 H LYS A 86 -5.292 -1.841 -10.543 1.00 10.00 H new ATOM 0 HA LYS A 86 -4.637 -0.924 -13.071 1.00 10.00 H new ATOM 0 HB2 LYS A 86 -5.285 0.411 -10.378 1.00 10.00 H new ATOM 0 HB3 LYS A 86 -5.144 1.354 -11.849 1.00 10.00 H new ATOM 0 HG2 LYS A 86 -7.086 -0.978 -11.611 1.00 10.00 H new ATOM 0 HG3 LYS A 86 -7.518 0.648 -11.120 1.00 10.00 H new ATOM 0 HD2 LYS A 86 -6.781 1.390 -13.513 1.00 10.00 H new ATOM 0 HD3 LYS A 86 -6.789 -0.314 -13.921 1.00 10.00 H new ATOM 0 HE2 LYS A 86 -9.144 -0.528 -13.262 1.00 10.00 H new ATOM 0 HE3 LYS A 86 -9.162 1.104 -12.625 1.00 10.00 H new ATOM 0 HZ1 LYS A 86 -10.176 0.999 -14.796 1.00 10.00 H new ATOM 0 HZ2 LYS A 86 -8.770 1.949 -14.856 1.00 10.00 H new ATOM 0 HZ3 LYS A 86 -8.752 0.368 -15.473 1.00 10.00 H new ATOM 1361 N LYS A 87 -2.227 -0.263 -10.991 1.00 10.00 N ATOM 1362 CA LYS A 87 -0.867 0.273 -10.821 1.00 10.00 C ATOM 1363 C LYS A 87 -0.157 -0.466 -9.679 1.00 10.00 C ATOM 1364 O LYS A 87 -0.804 -0.871 -8.711 1.00 10.00 O ATOM 1365 CB LYS A 87 -0.942 1.800 -10.567 1.00 10.00 C ATOM 1366 CG LYS A 87 -1.584 2.163 -9.216 1.00 10.00 C ATOM 1367 CD LYS A 87 -2.398 3.468 -9.194 1.00 10.00 C ATOM 1368 CE LYS A 87 -3.798 3.257 -9.796 1.00 10.00 C ATOM 1369 NZ LYS A 87 -4.679 4.435 -9.613 1.00 10.00 N ATOM 0 H LYS A 87 -2.530 -0.817 -10.190 1.00 10.00 H new ATOM 0 HA LYS A 87 -0.284 0.113 -11.728 1.00 10.00 H new ATOM 0 HB2 LYS A 87 0.064 2.218 -10.607 1.00 10.00 H new ATOM 0 HB3 LYS A 87 -1.513 2.267 -11.370 1.00 10.00 H new ATOM 0 HG2 LYS A 87 -2.236 1.344 -8.913 1.00 10.00 H new ATOM 0 HG3 LYS A 87 -0.795 2.236 -8.467 1.00 10.00 H new ATOM 0 HD2 LYS A 87 -2.490 3.826 -8.169 1.00 10.00 H new ATOM 0 HD3 LYS A 87 -1.870 4.239 -9.755 1.00 10.00 H new ATOM 0 HE2 LYS A 87 -3.703 3.040 -10.860 1.00 10.00 H new ATOM 0 HE3 LYS A 87 -4.261 2.386 -9.333 1.00 10.00 H new ATOM 0 HZ1 LYS A 87 -5.609 4.242 -10.036 1.00 10.00 H new ATOM 0 HZ2 LYS A 87 -4.794 4.628 -8.598 1.00 10.00 H new ATOM 0 HZ3 LYS A 87 -4.253 5.263 -10.077 1.00 10.00 H new ATOM 1383 N LYS A 88 1.171 -0.619 -9.758 1.00 10.00 N ATOM 1384 CA LYS A 88 1.943 -1.435 -8.800 1.00 10.00 C ATOM 1385 C LYS A 88 1.894 -0.924 -7.347 1.00 10.00 C ATOM 1386 O LYS A 88 2.097 -1.697 -6.416 1.00 10.00 O ATOM 1387 CB LYS A 88 3.373 -1.661 -9.322 1.00 10.00 C ATOM 1388 CG LYS A 88 4.324 -0.457 -9.186 1.00 10.00 C ATOM 1389 CD LYS A 88 5.180 -0.545 -7.913 1.00 10.00 C ATOM 1390 CE LYS A 88 6.044 0.707 -7.746 1.00 10.00 C ATOM 1391 NZ LYS A 88 6.900 0.589 -6.544 1.00 10.00 N ATOM 0 H LYS A 88 1.742 -0.185 -10.483 1.00 10.00 H new ATOM 0 HA LYS A 88 1.450 -2.405 -8.741 1.00 10.00 H new ATOM 0 HB2 LYS A 88 3.807 -2.507 -8.789 1.00 10.00 H new ATOM 0 HB3 LYS A 88 3.318 -1.942 -10.374 1.00 10.00 H new ATOM 0 HG2 LYS A 88 4.975 -0.408 -10.059 1.00 10.00 H new ATOM 0 HG3 LYS A 88 3.743 0.465 -9.170 1.00 10.00 H new ATOM 0 HD2 LYS A 88 4.534 -0.664 -7.043 1.00 10.00 H new ATOM 0 HD3 LYS A 88 5.818 -1.428 -7.959 1.00 10.00 H new ATOM 0 HE2 LYS A 88 6.666 0.848 -8.630 1.00 10.00 H new ATOM 0 HE3 LYS A 88 5.407 1.587 -7.661 1.00 10.00 H new ATOM 0 HZ1 LYS A 88 7.133 1.538 -6.189 1.00 10.00 H new ATOM 0 HZ2 LYS A 88 6.393 0.059 -5.807 1.00 10.00 H new ATOM 0 HZ3 LYS A 88 7.777 0.087 -6.790 1.00 10.00 H new ATOM 1405 N THR A 89 1.562 0.351 -7.125 1.00 10.00 N ATOM 1406 CA THR A 89 1.308 0.891 -5.781 1.00 10.00 C ATOM 1407 C THR A 89 0.159 0.148 -5.092 1.00 10.00 C ATOM 1408 O THR A 89 0.296 -0.242 -3.937 1.00 10.00 O ATOM 1409 CB THR A 89 0.995 2.396 -5.838 1.00 10.00 C ATOM 1410 OG1 THR A 89 1.881 3.041 -6.726 1.00 10.00 O ATOM 1411 CG2 THR A 89 1.145 3.053 -4.464 1.00 10.00 C ATOM 0 H THR A 89 1.461 1.040 -7.870 1.00 10.00 H new ATOM 0 HA THR A 89 2.217 0.744 -5.197 1.00 10.00 H new ATOM 0 HB THR A 89 -0.036 2.498 -6.177 1.00 10.00 H new ATOM 0 HG1 THR A 89 1.673 3.998 -6.757 1.00 10.00 H new ATOM 0 HG21 THR A 89 0.916 4.116 -4.542 1.00 10.00 H new ATOM 0 HG22 THR A 89 0.458 2.585 -3.760 1.00 10.00 H new ATOM 0 HG23 THR A 89 2.168 2.927 -4.110 1.00 10.00 H new ATOM 1419 N GLU A 90 -0.937 -0.108 -5.817 1.00 10.00 N ATOM 1420 CA GLU A 90 -2.108 -0.859 -5.348 1.00 10.00 C ATOM 1421 C GLU A 90 -1.744 -2.324 -5.057 1.00 10.00 C ATOM 1422 O GLU A 90 -2.246 -2.921 -4.103 1.00 10.00 O ATOM 1423 CB GLU A 90 -3.212 -0.807 -6.416 1.00 10.00 C ATOM 1424 CG GLU A 90 -3.671 0.610 -6.793 1.00 10.00 C ATOM 1425 CD GLU A 90 -4.659 1.213 -5.802 1.00 10.00 C ATOM 1426 OE1 GLU A 90 -4.306 1.338 -4.615 1.00 10.00 O ATOM 1427 OE2 GLU A 90 -5.769 1.583 -6.253 1.00 10.00 O ATOM 0 H GLU A 90 -1.036 0.213 -6.780 1.00 10.00 H new ATOM 0 HA GLU A 90 -2.462 -0.402 -4.424 1.00 10.00 H new ATOM 0 HB2 GLU A 90 -2.854 -1.310 -7.314 1.00 10.00 H new ATOM 0 HB3 GLU A 90 -4.073 -1.370 -6.057 1.00 10.00 H new ATOM 0 HG2 GLU A 90 -2.798 1.259 -6.864 1.00 10.00 H new ATOM 0 HG3 GLU A 90 -4.130 0.584 -7.781 1.00 10.00 H new ATOM 1434 N ARG A 91 -0.837 -2.894 -5.868 1.00 10.00 N ATOM 1435 CA ARG A 91 -0.269 -4.236 -5.695 1.00 10.00 C ATOM 1436 C ARG A 91 0.467 -4.360 -4.352 1.00 10.00 C ATOM 1437 O ARG A 91 0.203 -5.321 -3.622 1.00 10.00 O ATOM 1438 CB ARG A 91 0.596 -4.585 -6.933 1.00 10.00 C ATOM 1439 CG ARG A 91 1.283 -5.959 -6.995 1.00 10.00 C ATOM 1440 CD ARG A 91 0.320 -7.139 -6.879 1.00 10.00 C ATOM 1441 NE ARG A 91 0.023 -7.351 -5.457 1.00 10.00 N ATOM 1442 CZ ARG A 91 -0.959 -8.015 -4.900 1.00 10.00 C ATOM 1443 NH1 ARG A 91 -1.471 -9.097 -5.401 1.00 10.00 N ATOM 1444 NH2 ARG A 91 -1.424 -7.571 -3.771 1.00 10.00 N ATOM 0 H ARG A 91 -0.468 -2.414 -6.689 1.00 10.00 H new ATOM 0 HA ARG A 91 -1.064 -4.980 -5.643 1.00 10.00 H new ATOM 0 HB2 ARG A 91 -0.038 -4.493 -7.815 1.00 10.00 H new ATOM 0 HB3 ARG A 91 1.372 -3.824 -7.018 1.00 10.00 H new ATOM 0 HG2 ARG A 91 1.829 -6.039 -7.935 1.00 10.00 H new ATOM 0 HG3 ARG A 91 2.019 -6.023 -6.193 1.00 10.00 H new ATOM 0 HD2 ARG A 91 -0.597 -6.937 -7.433 1.00 10.00 H new ATOM 0 HD3 ARG A 91 0.763 -8.035 -7.312 1.00 10.00 H new ATOM 0 HE ARG A 91 0.678 -6.917 -4.807 1.00 10.00 H new ATOM 0 HH11 ARG A 91 -1.109 -9.475 -6.276 1.00 10.00 H new ATOM 0 HH12 ARG A 91 -2.236 -9.570 -4.919 1.00 10.00 H new ATOM 0 HH21 ARG A 91 -1.025 -6.733 -3.349 1.00 10.00 H new ATOM 0 HH22 ARG A 91 -2.189 -8.061 -3.306 1.00 10.00 H new ATOM 1458 N GLU A 92 1.331 -3.403 -4.005 1.00 10.00 N ATOM 1459 CA GLU A 92 1.947 -3.304 -2.668 1.00 10.00 C ATOM 1460 C GLU A 92 0.882 -3.156 -1.566 1.00 10.00 C ATOM 1461 O GLU A 92 0.890 -3.882 -0.574 1.00 10.00 O ATOM 1462 CB GLU A 92 2.843 -2.061 -2.589 1.00 10.00 C ATOM 1463 CG GLU A 92 4.023 -1.964 -3.563 1.00 10.00 C ATOM 1464 CD GLU A 92 4.517 -0.513 -3.738 1.00 10.00 C ATOM 1465 OE1 GLU A 92 3.937 0.415 -3.119 1.00 10.00 O ATOM 1466 OE2 GLU A 92 5.469 -0.327 -4.529 1.00 10.00 O ATOM 0 H GLU A 92 1.629 -2.667 -4.645 1.00 10.00 H new ATOM 0 HA GLU A 92 2.520 -4.219 -2.516 1.00 10.00 H new ATOM 0 HB2 GLU A 92 2.213 -1.184 -2.739 1.00 10.00 H new ATOM 0 HB3 GLU A 92 3.240 -1.999 -1.576 1.00 10.00 H new ATOM 0 HG2 GLU A 92 4.843 -2.584 -3.200 1.00 10.00 H new ATOM 0 HG3 GLU A 92 3.726 -2.364 -4.532 1.00 10.00 H new ATOM 1473 N ASP A 93 -0.029 -2.193 -1.748 1.00 10.00 N ATOM 1474 CA ASP A 93 -1.056 -1.792 -0.785 1.00 10.00 C ATOM 1475 C ASP A 93 -1.961 -2.960 -0.363 1.00 10.00 C ATOM 1476 O ASP A 93 -2.234 -3.145 0.824 1.00 10.00 O ATOM 1477 CB ASP A 93 -1.882 -0.665 -1.417 1.00 10.00 C ATOM 1478 CG ASP A 93 -1.652 0.692 -0.764 1.00 10.00 C ATOM 1479 OD1 ASP A 93 -0.687 1.372 -1.190 1.00 10.00 O ATOM 1480 OD2 ASP A 93 -2.461 1.069 0.112 1.00 10.00 O ATOM 0 H ASP A 93 -0.071 -1.649 -2.610 1.00 10.00 H new ATOM 0 HA ASP A 93 -0.568 -1.449 0.127 1.00 10.00 H new ATOM 0 HB2 ASP A 93 -1.638 -0.596 -2.477 1.00 10.00 H new ATOM 0 HB3 ASP A 93 -2.940 -0.918 -1.349 1.00 10.00 H new ATOM 1485 N LEU A 94 -2.396 -3.785 -1.323 1.00 10.00 N ATOM 1486 CA LEU A 94 -3.127 -5.023 -1.051 1.00 10.00 C ATOM 1487 C LEU A 94 -2.370 -6.006 -0.152 1.00 10.00 C ATOM 1488 O LEU A 94 -3.008 -6.659 0.673 1.00 10.00 O ATOM 1489 CB LEU A 94 -3.464 -5.706 -2.381 1.00 10.00 C ATOM 1490 CG LEU A 94 -4.918 -5.602 -2.828 1.00 10.00 C ATOM 1491 CD1 LEU A 94 -5.486 -4.191 -2.812 1.00 10.00 C ATOM 1492 CD2 LEU A 94 -5.016 -6.155 -4.248 1.00 10.00 C ATOM 0 H LEU A 94 -2.248 -3.609 -2.317 1.00 10.00 H new ATOM 0 HA LEU A 94 -4.029 -4.742 -0.507 1.00 10.00 H new ATOM 0 HB2 LEU A 94 -2.832 -5.277 -3.159 1.00 10.00 H new ATOM 0 HB3 LEU A 94 -3.202 -6.761 -2.303 1.00 10.00 H new ATOM 0 HG LEU A 94 -5.509 -6.172 -2.111 1.00 10.00 H new ATOM 0 HD11 LEU A 94 -6.524 -4.213 -3.144 1.00 10.00 H new ATOM 0 HD12 LEU A 94 -5.438 -3.791 -1.799 1.00 10.00 H new ATOM 0 HD13 LEU A 94 -4.904 -3.557 -3.481 1.00 10.00 H new ATOM 0 HD21 LEU A 94 -6.048 -6.092 -4.593 1.00 10.00 H new ATOM 0 HD22 LEU A 94 -4.376 -5.572 -4.910 1.00 10.00 H new ATOM 0 HD23 LEU A 94 -4.694 -7.196 -4.256 1.00 10.00 H new ATOM 1504 N ILE A 95 -1.043 -6.127 -0.306 1.00 10.00 N ATOM 1505 CA ILE A 95 -0.211 -6.934 0.600 1.00 10.00 C ATOM 1506 C ILE A 95 -0.307 -6.369 2.018 1.00 10.00 C ATOM 1507 O ILE A 95 -0.595 -7.124 2.946 1.00 10.00 O ATOM 1508 CB ILE A 95 1.248 -7.093 0.078 1.00 10.00 C ATOM 1509 CG1 ILE A 95 1.459 -8.497 -0.518 1.00 10.00 C ATOM 1510 CG2 ILE A 95 2.345 -6.902 1.144 1.00 10.00 C ATOM 1511 CD1 ILE A 95 0.617 -8.767 -1.758 1.00 10.00 C ATOM 0 H ILE A 95 -0.520 -5.673 -1.055 1.00 10.00 H new ATOM 0 HA ILE A 95 -0.596 -7.953 0.630 1.00 10.00 H new ATOM 0 HB ILE A 95 1.350 -6.299 -0.662 1.00 10.00 H new ATOM 0 HG12 ILE A 95 2.512 -8.621 -0.770 1.00 10.00 H new ATOM 0 HG13 ILE A 95 1.223 -9.244 0.240 1.00 10.00 H new ATOM 0 HG21 ILE A 95 3.325 -7.032 0.685 1.00 10.00 H new ATOM 0 HG22 ILE A 95 2.272 -5.900 1.566 1.00 10.00 H new ATOM 0 HG23 ILE A 95 2.215 -7.639 1.936 1.00 10.00 H new ATOM 0 HD11 ILE A 95 0.818 -9.774 -2.122 1.00 10.00 H new ATOM 0 HD12 ILE A 95 -0.440 -8.676 -1.507 1.00 10.00 H new ATOM 0 HD13 ILE A 95 0.869 -8.044 -2.534 1.00 10.00 H new ATOM 1523 N ALA A 96 -0.137 -5.051 2.179 1.00 10.00 N ATOM 1524 CA ALA A 96 -0.239 -4.380 3.472 1.00 10.00 C ATOM 1525 C ALA A 96 -1.622 -4.581 4.120 1.00 10.00 C ATOM 1526 O ALA A 96 -1.697 -5.016 5.269 1.00 10.00 O ATOM 1527 CB ALA A 96 0.138 -2.905 3.294 1.00 10.00 C ATOM 0 H ALA A 96 0.077 -4.419 1.407 1.00 10.00 H new ATOM 0 HA ALA A 96 0.464 -4.830 4.173 1.00 10.00 H new ATOM 0 HB1 ALA A 96 0.066 -2.393 4.253 1.00 10.00 H new ATOM 0 HB2 ALA A 96 1.159 -2.833 2.920 1.00 10.00 H new ATOM 0 HB3 ALA A 96 -0.543 -2.439 2.582 1.00 10.00 H new ATOM 1533 N TYR A 97 -2.709 -4.335 3.371 1.00 10.00 N ATOM 1534 CA TYR A 97 -4.084 -4.625 3.796 1.00 10.00 C ATOM 1535 C TYR A 97 -4.260 -6.098 4.205 1.00 10.00 C ATOM 1536 O TYR A 97 -4.610 -6.357 5.358 1.00 10.00 O ATOM 1537 CB TYR A 97 -5.099 -4.161 2.726 1.00 10.00 C ATOM 1538 CG TYR A 97 -6.366 -5.000 2.609 1.00 10.00 C ATOM 1539 CD1 TYR A 97 -7.315 -5.062 3.654 1.00 10.00 C ATOM 1540 CD2 TYR A 97 -6.547 -5.798 1.466 1.00 10.00 C ATOM 1541 CE1 TYR A 97 -8.420 -5.941 3.567 1.00 10.00 C ATOM 1542 CE2 TYR A 97 -7.634 -6.685 1.389 1.00 10.00 C ATOM 1543 CZ TYR A 97 -8.577 -6.767 2.429 1.00 10.00 C ATOM 1544 OH TYR A 97 -9.586 -7.678 2.307 1.00 10.00 O ATOM 0 H TYR A 97 -2.654 -3.923 2.440 1.00 10.00 H new ATOM 0 HA TYR A 97 -4.292 -4.047 4.696 1.00 10.00 H new ATOM 0 HB2 TYR A 97 -5.385 -3.132 2.945 1.00 10.00 H new ATOM 0 HB3 TYR A 97 -4.600 -4.153 1.757 1.00 10.00 H new ATOM 0 HD1 TYR A 97 -7.196 -4.434 4.525 1.00 10.00 H new ATOM 0 HD2 TYR A 97 -5.849 -5.729 0.645 1.00 10.00 H new ATOM 0 HE1 TYR A 97 -9.143 -5.982 4.368 1.00 10.00 H new ATOM 0 HE2 TYR A 97 -7.747 -7.313 0.518 1.00 10.00 H new ATOM 0 HH TYR A 97 -10.267 -7.505 2.990 1.00 10.00 H new ATOM 1554 N LEU A 98 -4.001 -7.065 3.312 1.00 10.00 N ATOM 1555 CA LEU A 98 -4.216 -8.482 3.626 1.00 10.00 C ATOM 1556 C LEU A 98 -3.332 -8.959 4.780 1.00 10.00 C ATOM 1557 O LEU A 98 -3.814 -9.715 5.622 1.00 10.00 O ATOM 1558 CB LEU A 98 -4.040 -9.373 2.382 1.00 10.00 C ATOM 1559 CG LEU A 98 -5.230 -9.281 1.410 1.00 10.00 C ATOM 1560 CD1 LEU A 98 -4.900 -9.943 0.071 1.00 10.00 C ATOM 1561 CD2 LEU A 98 -6.500 -9.949 1.956 1.00 10.00 C ATOM 0 H LEU A 98 -3.644 -6.891 2.372 1.00 10.00 H new ATOM 0 HA LEU A 98 -5.251 -8.575 3.956 1.00 10.00 H new ATOM 0 HB2 LEU A 98 -3.127 -9.085 1.860 1.00 10.00 H new ATOM 0 HB3 LEU A 98 -3.913 -10.409 2.697 1.00 10.00 H new ATOM 0 HG LEU A 98 -5.416 -8.215 1.282 1.00 10.00 H new ATOM 0 HD11 LEU A 98 -5.759 -9.863 -0.596 1.00 10.00 H new ATOM 0 HD12 LEU A 98 -4.042 -9.444 -0.380 1.00 10.00 H new ATOM 0 HD13 LEU A 98 -4.664 -10.995 0.233 1.00 10.00 H new ATOM 0 HD21 LEU A 98 -7.304 -9.852 1.227 1.00 10.00 H new ATOM 0 HD22 LEU A 98 -6.304 -11.005 2.142 1.00 10.00 H new ATOM 0 HD23 LEU A 98 -6.794 -9.465 2.887 1.00 10.00 H new ATOM 1573 N LYS A 99 -2.090 -8.467 4.907 1.00 10.00 N ATOM 1574 CA LYS A 99 -1.203 -8.827 6.020 1.00 10.00 C ATOM 1575 C LYS A 99 -1.716 -8.331 7.380 1.00 10.00 C ATOM 1576 O LYS A 99 -1.334 -8.916 8.397 1.00 10.00 O ATOM 1577 CB LYS A 99 0.242 -8.395 5.707 1.00 10.00 C ATOM 1578 CG LYS A 99 1.339 -8.896 6.668 1.00 10.00 C ATOM 1579 CD LYS A 99 1.739 -10.384 6.571 1.00 10.00 C ATOM 1580 CE LYS A 99 0.715 -11.442 7.016 1.00 10.00 C ATOM 1581 NZ LYS A 99 0.186 -11.227 8.387 1.00 10.00 N ATOM 0 H LYS A 99 -1.676 -7.812 4.244 1.00 10.00 H new ATOM 0 HA LYS A 99 -1.203 -9.913 6.117 1.00 10.00 H new ATOM 0 HB2 LYS A 99 0.489 -8.736 4.702 1.00 10.00 H new ATOM 0 HB3 LYS A 99 0.275 -7.306 5.691 1.00 10.00 H new ATOM 0 HG2 LYS A 99 2.233 -8.295 6.502 1.00 10.00 H new ATOM 0 HG3 LYS A 99 1.008 -8.701 7.688 1.00 10.00 H new ATOM 0 HD2 LYS A 99 2.002 -10.591 5.534 1.00 10.00 H new ATOM 0 HD3 LYS A 99 2.643 -10.525 7.164 1.00 10.00 H new ATOM 0 HE2 LYS A 99 -0.117 -11.447 6.312 1.00 10.00 H new ATOM 0 HE3 LYS A 99 1.180 -12.427 6.966 1.00 10.00 H new ATOM 0 HZ1 LYS A 99 -0.534 -11.947 8.598 1.00 10.00 H new ATOM 0 HZ2 LYS A 99 0.963 -11.302 9.075 1.00 10.00 H new ATOM 0 HZ3 LYS A 99 -0.242 -10.281 8.450 1.00 10.00 H new ATOM 1595 N LYS A 100 -2.672 -7.390 7.411 1.00 10.00 N ATOM 1596 CA LYS A 100 -3.470 -7.033 8.597 1.00 10.00 C ATOM 1597 C LYS A 100 -4.949 -7.458 8.516 1.00 10.00 C ATOM 1598 O LYS A 100 -5.770 -6.912 9.249 1.00 10.00 O ATOM 1599 CB LYS A 100 -3.265 -5.555 8.976 1.00 10.00 C ATOM 1600 CG LYS A 100 -4.004 -4.547 8.073 1.00 10.00 C ATOM 1601 CD LYS A 100 -4.395 -3.255 8.811 1.00 10.00 C ATOM 1602 CE LYS A 100 -5.303 -3.451 10.039 1.00 10.00 C ATOM 1603 NZ LYS A 100 -6.498 -4.282 9.759 1.00 10.00 N ATOM 0 H LYS A 100 -2.919 -6.840 6.589 1.00 10.00 H new ATOM 0 HA LYS A 100 -3.085 -7.630 9.423 1.00 10.00 H new ATOM 0 HB2 LYS A 100 -3.595 -5.409 10.005 1.00 10.00 H new ATOM 0 HB3 LYS A 100 -2.198 -5.332 8.948 1.00 10.00 H new ATOM 0 HG2 LYS A 100 -3.370 -4.296 7.223 1.00 10.00 H new ATOM 0 HG3 LYS A 100 -4.902 -5.017 7.673 1.00 10.00 H new ATOM 0 HD2 LYS A 100 -3.484 -2.748 9.130 1.00 10.00 H new ATOM 0 HD3 LYS A 100 -4.900 -2.592 8.108 1.00 10.00 H new ATOM 0 HE2 LYS A 100 -4.726 -3.915 10.838 1.00 10.00 H new ATOM 0 HE3 LYS A 100 -5.625 -2.475 10.403 1.00 10.00 H new ATOM 0 HZ1 LYS A 100 -7.221 -4.106 10.485 1.00 10.00 H new ATOM 0 HZ2 LYS A 100 -6.880 -4.037 8.823 1.00 10.00 H new ATOM 0 HZ3 LYS A 100 -6.232 -5.287 9.772 1.00 10.00 H new ATOM 1617 N ALA A 101 -5.281 -8.428 7.654 1.00 10.00 N ATOM 1618 CA ALA A 101 -6.541 -9.178 7.657 1.00 10.00 C ATOM 1619 C ALA A 101 -6.341 -10.675 8.004 1.00 10.00 C ATOM 1620 O ALA A 101 -7.306 -11.429 8.093 1.00 10.00 O ATOM 1621 CB ALA A 101 -7.226 -8.989 6.298 1.00 10.00 C ATOM 0 H ALA A 101 -4.653 -8.722 6.906 1.00 10.00 H new ATOM 0 HA ALA A 101 -7.184 -8.785 8.445 1.00 10.00 H new ATOM 0 HB1 ALA A 101 -8.166 -9.541 6.284 1.00 10.00 H new ATOM 0 HB2 ALA A 101 -7.425 -7.930 6.135 1.00 10.00 H new ATOM 0 HB3 ALA A 101 -6.575 -9.361 5.507 1.00 10.00 H new ATOM 1627 N THR A 102 -5.094 -11.123 8.232 1.00 10.00 N ATOM 1628 CA THR A 102 -4.770 -12.487 8.709 1.00 10.00 C ATOM 1629 C THR A 102 -4.902 -12.639 10.234 1.00 10.00 C ATOM 1630 O THR A 102 -4.603 -13.709 10.760 1.00 10.00 O ATOM 1631 CB THR A 102 -3.355 -12.963 8.279 1.00 10.00 C ATOM 1632 OG1 THR A 102 -2.356 -12.741 9.266 1.00 10.00 O ATOM 1633 CG2 THR A 102 -2.810 -12.316 7.015 1.00 10.00 C ATOM 0 H THR A 102 -4.268 -10.542 8.089 1.00 10.00 H new ATOM 0 HA THR A 102 -5.514 -13.121 8.227 1.00 10.00 H new ATOM 0 HB THR A 102 -3.535 -14.025 8.112 1.00 10.00 H new ATOM 0 HG1 THR A 102 -1.750 -13.511 9.297 1.00 10.00 H new ATOM 0 HG21 THR A 102 -1.819 -12.715 6.800 1.00 10.00 H new ATOM 0 HG22 THR A 102 -3.476 -12.531 6.180 1.00 10.00 H new ATOM 0 HG23 THR A 102 -2.744 -11.237 7.158 1.00 10.00 H new ATOM 1641 N ASN A 103 -5.193 -11.544 10.944 1.00 10.00 N ATOM 1642 CA ASN A 103 -4.954 -11.383 12.383 1.00 10.00 C ATOM 1643 C ASN A 103 -5.883 -10.353 13.062 1.00 10.00 C ATOM 1644 O ASN A 103 -5.737 -10.105 14.258 1.00 10.00 O ATOM 1645 CB ASN A 103 -3.464 -11.027 12.587 1.00 10.00 C ATOM 1646 CG ASN A 103 -2.960 -9.901 11.689 1.00 10.00 C ATOM 1647 OD1 ASN A 103 -3.026 -8.726 12.002 1.00 10.00 O ATOM 1648 ND2 ASN A 103 -2.430 -10.234 10.529 1.00 10.00 N ATOM 0 H ASN A 103 -5.615 -10.718 10.519 1.00 10.00 H new ATOM 0 HA ASN A 103 -5.193 -12.327 12.873 1.00 10.00 H new ATOM 0 HB2 ASN A 103 -3.309 -10.743 13.628 1.00 10.00 H new ATOM 0 HB3 ASN A 103 -2.862 -11.917 12.407 1.00 10.00 H new ATOM 0 HD21 ASN A 103 -2.079 -9.510 9.902 1.00 10.00 H new ATOM 0 HD22 ASN A 103 -2.371 -11.216 10.258 1.00 10.00 H new ATOM 1655 N GLU A 104 -6.833 -9.774 12.319 1.00 10.00 N ATOM 1656 CA GLU A 104 -7.731 -8.682 12.703 1.00 10.00 C ATOM 1657 C GLU A 104 -8.891 -8.652 11.697 1.00 10.00 C ATOM 1658 O GLU A 104 -8.606 -8.941 10.508 1.00 10.00 O ATOM 1659 CB GLU A 104 -6.950 -7.354 12.667 1.00 10.00 C ATOM 1660 CG GLU A 104 -7.677 -6.170 13.324 1.00 10.00 C ATOM 1661 CD GLU A 104 -7.173 -4.844 12.739 1.00 10.00 C ATOM 1662 OE1 GLU A 104 -5.977 -4.516 12.898 1.00 10.00 O ATOM 1663 OE2 GLU A 104 -7.945 -4.196 11.991 1.00 10.00 O ATOM 1664 OXT GLU A 104 -10.031 -8.407 12.139 1.00 10.00 O ATOM 0 H GLU A 104 -7.006 -10.081 11.362 1.00 10.00 H new ATOM 0 HA GLU A 104 -8.121 -8.828 13.710 1.00 10.00 H new ATOM 0 HB2 GLU A 104 -5.991 -7.497 13.165 1.00 10.00 H new ATOM 0 HB3 GLU A 104 -6.735 -7.101 11.629 1.00 10.00 H new ATOM 0 HG2 GLU A 104 -8.751 -6.261 13.164 1.00 10.00 H new ATOM 0 HG3 GLU A 104 -7.512 -6.186 14.401 1.00 10.00 H new TER 1671 GLU A 104 HETATM 1672 FE HEC A 105 -9.051 -13.330 -7.730 1.00 10.00 FE HETATM 1673 CHA HEC A 105 -8.357 -16.632 -6.907 1.00 10.00 C HETATM 1674 CHB HEC A 105 -6.898 -12.337 -5.316 1.00 10.00 C HETATM 1675 CHC HEC A 105 -9.935 -10.153 -8.322 1.00 10.00 C HETATM 1676 CHD HEC A 105 -11.493 -14.456 -9.778 1.00 10.00 C HETATM 1677 NA HEC A 105 -7.811 -14.290 -6.460 1.00 10.00 N HETATM 1678 C1A HEC A 105 -7.683 -15.650 -6.213 1.00 10.00 C HETATM 1679 C2A HEC A 105 -6.755 -15.905 -5.128 1.00 10.00 C HETATM 1680 C3A HEC A 105 -6.403 -14.691 -4.647 1.00 10.00 C HETATM 1681 C4A HEC A 105 -7.055 -13.697 -5.476 1.00 10.00 C HETATM 1682 CMA HEC A 105 -5.477 -14.417 -3.490 1.00 10.00 C HETATM 1683 CAA HEC A 105 -6.237 -17.249 -4.656 1.00 10.00 C HETATM 1684 CBA HEC A 105 -7.203 -18.147 -3.855 1.00 10.00 C HETATM 1685 CGA HEC A 105 -6.515 -19.329 -3.162 1.00 10.00 C HETATM 1686 O1A HEC A 105 -5.816 -20.095 -3.861 1.00 10.00 O HETATM 1687 O2A HEC A 105 -6.631 -19.431 -1.922 1.00 10.00 O HETATM 1688 NB HEC A 105 -8.437 -11.589 -7.060 1.00 10.00 N HETATM 1689 C1B HEC A 105 -7.559 -11.359 -6.032 1.00 10.00 C HETATM 1690 C2B HEC A 105 -7.426 -9.944 -5.756 1.00 10.00 C HETATM 1691 C3B HEC A 105 -8.247 -9.293 -6.629 1.00 10.00 C HETATM 1692 C4B HEC A 105 -8.901 -10.343 -7.419 1.00 10.00 C HETATM 1693 CMB HEC A 105 -6.517 -9.379 -4.682 1.00 10.00 C HETATM 1694 CAB HEC A 105 -8.439 -7.788 -6.803 1.00 10.00 C HETATM 1695 CBB HEC A 105 -7.230 -7.149 -7.486 1.00 10.00 C HETATM 1696 NC HEC A 105 -10.519 -12.505 -8.662 1.00 10.00 N HETATM 1697 C1C HEC A 105 -10.705 -11.161 -8.878 1.00 10.00 C HETATM 1698 C2C HEC A 105 -11.926 -10.926 -9.627 1.00 10.00 C HETATM 1699 C3C HEC A 105 -12.501 -12.145 -9.799 1.00 10.00 C HETATM 1700 C4C HEC A 105 -11.507 -13.121 -9.394 1.00 10.00 C HETATM 1701 CMC HEC A 105 -12.485 -9.563 -9.970 1.00 10.00 C HETATM 1702 CAC HEC A 105 -13.902 -12.475 -10.273 1.00 10.00 C HETATM 1703 CBC HEC A 105 -14.081 -12.334 -11.790 1.00 10.00 C HETATM 1704 ND HEC A 105 -9.713 -15.147 -8.287 1.00 10.00 N HETATM 1705 C1D HEC A 105 -10.590 -15.397 -9.314 1.00 10.00 C HETATM 1706 C2D HEC A 105 -10.507 -16.795 -9.741 1.00 10.00 C HETATM 1707 C3D HEC A 105 -9.828 -17.440 -8.760 1.00 10.00 C HETATM 1708 C4D HEC A 105 -9.258 -16.398 -7.925 1.00 10.00 C HETATM 1709 CMD HEC A 105 -11.105 -17.411 -10.989 1.00 10.00 C HETATM 1710 CAD HEC A 105 -9.626 -18.936 -8.572 1.00 10.00 C HETATM 1711 CBD HEC A 105 -8.178 -19.458 -8.721 1.00 10.00 C HETATM 1712 CGD HEC A 105 -7.815 -20.144 -10.034 1.00 10.00 C HETATM 1713 O1D HEC A 105 -8.624 -20.155 -10.987 1.00 10.00 O HETATM 1714 O2D HEC A 105 -6.681 -20.669 -10.049 1.00 10.00 O HETATM 0 HMD3 HEC A 105 -12.187 -17.282 -10.975 1.00 10.00 H new HETATM 0 HMD2 HEC A 105 -10.692 -16.920 -11.871 1.00 10.00 H new HETATM 0 HMD1 HEC A 105 -10.866 -18.474 -11.020 1.00 10.00 H new HETATM 0 HMC3 HEC A 105 -12.690 -9.012 -9.052 1.00 10.00 H new HETATM 0 HMC2 HEC A 105 -11.760 -9.012 -10.569 1.00 10.00 H new HETATM 0 HMC1 HEC A 105 -13.409 -9.681 -10.537 1.00 10.00 H new HETATM 0 HMB3 HEC A 105 -6.815 -9.772 -3.710 1.00 10.00 H new HETATM 0 HMB2 HEC A 105 -5.486 -9.667 -4.889 1.00 10.00 H new HETATM 0 HMB1 HEC A 105 -6.596 -8.292 -4.674 1.00 10.00 H new HETATM 0 HMA3 HEC A 105 -5.878 -14.877 -2.587 1.00 10.00 H new HETATM 0 HMA2 HEC A 105 -4.493 -14.835 -3.704 1.00 10.00 H new HETATM 0 HMA1 HEC A 105 -5.389 -13.341 -3.341 1.00 10.00 H new HETATM 0 HBD2 HEC A 105 -7.500 -18.616 -8.581 1.00 10.00 H new HETATM 0 HBD1 HEC A 105 -7.987 -20.160 -7.909 1.00 10.00 H new HETATM 0 HBC3 HEC A 105 -13.868 -11.307 -12.088 1.00 10.00 H new HETATM 0 HBC2 HEC A 105 -13.395 -13.009 -12.302 1.00 10.00 H new HETATM 0 HBC1 HEC A 105 -15.107 -12.585 -12.060 1.00 10.00 H new HETATM 0 HBB3 HEC A 105 -6.339 -7.317 -6.881 1.00 10.00 H new HETATM 0 HBB2 HEC A 105 -7.089 -7.596 -8.470 1.00 10.00 H new HETATM 0 HBB1 HEC A 105 -7.398 -6.078 -7.595 1.00 10.00 H new HETATM 0 HBA2 HEC A 105 -7.709 -17.541 -3.103 1.00 10.00 H new HETATM 0 HBA1 HEC A 105 -7.972 -18.529 -4.527 1.00 10.00 H new HETATM 0 HAD2 HEC A 105 -9.987 -19.207 -7.580 1.00 10.00 H new HETATM 0 HAD1 HEC A 105 -10.254 -19.459 -9.294 1.00 10.00 H new HETATM 0 HAA2 HEC A 105 -5.907 -17.808 -5.532 1.00 10.00 H new HETATM 0 HAA1 HEC A 105 -5.355 -17.072 -4.040 1.00 10.00 H new HETATM 0 HHD HEC A 105 -12.245 -14.785 -10.495 1.00 10.00 H new HETATM 0 HHC HEC A 105 -10.160 -9.128 -8.618 1.00 10.00 H new HETATM 0 HHB HEC A 105 -6.190 -12.004 -4.557 1.00 10.00 H new HETATM 0 HHA HEC A 105 -8.164 -17.669 -6.631 1.00 10.00 H new HETATM 0 H2D HEC A 105 -6.002 -19.978 -10.197 1.00 10.00 H new HETATM 0 H2A HEC A 105 -5.794 -19.159 -1.492 1.00 10.00 H new